USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 814 LYS NZ :NH3+ 161:sc= -4.73! (180deg=-4.83) USER MOD Set 1.2: A 902 GLN : amide:sc= -1.72 K(o=-6.5,f=-4.8) USER MOD Set 2.1: A 869 CYS SG : rot 66:sc= -0.2 USER MOD Set 2.2: A 870 SER OG : rot 180:sc= 0.159 USER MOD Set 3.1: A 858 LYS NZ :NH3+ -178:sc= -6.04! (180deg=-5.31!) USER MOD Set 3.2: A 861 LYS NZ :NH3+ -163:sc= -0.206 (180deg=0) USER MOD Set 4.1: A 810 CYS SG : rot 170:sc= -0.194 USER MOD Set 4.2: A 871 HIS : no HD1:sc= -10.1! C(o=-10!,f=-10!) USER MOD Single : A 805 ASN : amide:sc= -7.06! K(o=-7.1!,f=-2) USER MOD Single : A 806 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 807 LYS NZ :NH3+ -110:sc= 0.0745 (180deg=-0.26) USER MOD Single : A 812 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 813 CYS SG : rot 180:sc= 0 USER MOD Single : A 818 CYS SG : rot 180:sc= -0.0275 USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot 97:sc= -0.0922! USER MOD Single : A 829 CYS SG : rot 180:sc= 0 USER MOD Single : A 830 HIS : no HD1:sc= -6.51! C(o=-6.5!,f=-5.9!) USER MOD Single : A 831 TYR OH : rot 130:sc= -3.35 USER MOD Single : A 832 THR OG1 : rot 112:sc= 1.42 USER MOD Single : A 839 LYS NZ :NH3+ -132:sc= -0.372 (180deg=-1.4!) USER MOD Single : A 841 CYS SG : rot 81:sc= 1.22 USER MOD Single : A 844 SER OG : rot 180:sc= 0 USER MOD Single : A 864 CYS SG : rot 89:sc= -0.157 USER MOD Single : A 867 GLN : amide:sc=-0.00498 K(o=-0.005,f=-1.2) USER MOD Single : A 868 ASN : amide:sc= -1.43 K(o=-1.4,f=-4.1!) USER MOD Single : A 876 HIS : no HE2:sc= -0.332 K(o=-0.33,f=-3.1!) USER MOD Single : A 878 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.047) USER MOD Single : A 879 TYR OH : rot -30:sc= -3.07! USER MOD Single : A 880 LYS NZ :NH3+ -119:sc= 0.428 (180deg=-2.95!) USER MOD Single : A 881 THR OG1 : rot -59:sc= 0.121 USER MOD Single : A 888 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 891 SER OG : rot 130:sc= -0.0784 USER MOD Single : A 899 THR OG1 : rot 160:sc= -3.32! USER MOD Single : A 903 THR OG1 : rot 180:sc= 0 USER MOD Single : A 905 TYR OH : rot 180:sc= 0 USER MOD Single : A 906 SER OG : rot 180:sc= 0 USER MOD Single : A 907 LYS NZ :NH3+ -171:sc= -4.37! (180deg=-4.71!) USER MOD Single : A 909 LYS NZ :NH3+ 168:sc=-0.00561 (180deg=-0.145) USER MOD Single : A 912 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.17) USER MOD Single : A 915 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 MET CE :methyl 143:sc= -1.36 (180deg=-3.18!) USER MOD Single : A 924 SER OG : rot 180:sc= -0.377 USER MOD Single : A 925 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 0.981 -25.006 -2.933 1.00 72.13 N ATOM 209 CA ASN A 805 1.604 -24.730 -1.650 1.00 21.40 C ATOM 210 C ASN A 805 0.841 -23.605 -0.949 1.00 0.23 C ATOM 211 O ASN A 805 0.325 -22.699 -1.602 1.00 35.42 O ATOM 212 CB ASN A 805 3.055 -24.279 -1.828 1.00 11.40 C ATOM 213 CG ASN A 805 3.548 -23.520 -0.594 1.00 41.34 C ATOM 214 OD1 ASN A 805 4.047 -22.409 -0.675 1.00 64.42 O ATOM 215 ND2 ASN A 805 3.381 -24.179 0.549 1.00 40.43 N ATOM 0 HA ASN A 805 1.581 -25.646 -1.060 1.00 21.40 H new ATOM 0 HB2 ASN A 805 3.691 -25.147 -2.004 1.00 11.40 H new ATOM 0 HB3 ASN A 805 3.136 -23.641 -2.708 1.00 11.40 H new ATOM 0 HD21 ASN A 805 3.678 -23.757 1.429 1.00 40.43 H new ATOM 0 HD22 ASN A 805 2.956 -25.106 0.546 1.00 40.43 H new ATOM 222 N LYS A 806 0.794 -23.698 0.372 1.00 23.31 N ATOM 223 CA LYS A 806 0.103 -22.699 1.169 1.00 20.10 C ATOM 224 C LYS A 806 1.057 -22.153 2.233 1.00 12.33 C ATOM 225 O LYS A 806 1.959 -22.857 2.684 1.00 71.10 O ATOM 226 CB LYS A 806 -1.194 -23.274 1.742 1.00 23.33 C ATOM 227 CG LYS A 806 -1.642 -22.491 2.978 1.00 42.11 C ATOM 228 CD LYS A 806 -3.146 -22.647 3.210 1.00 11.30 C ATOM 229 CE LYS A 806 -3.592 -24.090 2.967 1.00 42.05 C ATOM 230 NZ LYS A 806 -4.959 -24.306 3.491 1.00 3.23 N ATOM 0 H LYS A 806 1.224 -24.450 0.910 1.00 23.31 H new ATOM 0 HA LYS A 806 -0.197 -21.856 0.547 1.00 20.10 H new ATOM 0 HB2 LYS A 806 -1.976 -23.242 0.984 1.00 23.33 H new ATOM 0 HB3 LYS A 806 -1.047 -24.322 2.004 1.00 23.33 H new ATOM 0 HG2 LYS A 806 -1.097 -22.843 3.854 1.00 42.11 H new ATOM 0 HG3 LYS A 806 -1.397 -21.436 2.853 1.00 42.11 H new ATOM 0 HD2 LYS A 806 -3.392 -22.353 4.230 1.00 11.30 H new ATOM 0 HD3 LYS A 806 -3.691 -21.977 2.545 1.00 11.30 H new ATOM 0 HE2 LYS A 806 -3.567 -24.310 1.900 1.00 42.05 H new ATOM 0 HE3 LYS A 806 -2.898 -24.778 3.451 1.00 42.05 H new ATOM 0 HZ1 LYS A 806 -5.246 -25.291 3.318 1.00 3.23 H new ATOM 0 HZ2 LYS A 806 -4.973 -24.116 4.513 1.00 3.23 H new ATOM 0 HZ3 LYS A 806 -5.621 -23.663 3.011 1.00 3.23 H new ATOM 243 N LYS A 807 0.825 -20.902 2.604 1.00 32.11 N ATOM 244 CA LYS A 807 1.652 -20.253 3.607 1.00 62.11 C ATOM 245 C LYS A 807 0.963 -20.348 4.970 1.00 50.14 C ATOM 246 O LYS A 807 -0.249 -20.543 5.044 1.00 72.31 O ATOM 247 CB LYS A 807 1.983 -18.821 3.183 1.00 11.43 C ATOM 248 CG LYS A 807 2.417 -17.980 4.386 1.00 43.24 C ATOM 249 CD LYS A 807 2.602 -16.513 3.991 1.00 61.12 C ATOM 250 CE LYS A 807 1.331 -15.954 3.347 1.00 24.35 C ATOM 251 NZ LYS A 807 1.220 -14.500 3.598 1.00 1.12 N ATOM 0 H LYS A 807 0.076 -20.321 2.228 1.00 32.11 H new ATOM 0 HA LYS A 807 2.611 -20.763 3.699 1.00 62.11 H new ATOM 0 HB2 LYS A 807 2.778 -18.833 2.437 1.00 11.43 H new ATOM 0 HB3 LYS A 807 1.111 -18.366 2.712 1.00 11.43 H new ATOM 0 HG2 LYS A 807 1.670 -18.056 5.176 1.00 43.24 H new ATOM 0 HG3 LYS A 807 3.350 -18.372 4.791 1.00 43.24 H new ATOM 0 HD2 LYS A 807 2.856 -15.925 4.873 1.00 61.12 H new ATOM 0 HD3 LYS A 807 3.436 -16.422 3.296 1.00 61.12 H new ATOM 0 HE2 LYS A 807 1.346 -16.144 2.274 1.00 24.35 H new ATOM 0 HE3 LYS A 807 0.457 -16.466 3.749 1.00 24.35 H new ATOM 0 HZ1 LYS A 807 0.439 -14.321 4.261 1.00 1.12 H new ATOM 0 HZ2 LYS A 807 2.109 -14.150 4.008 1.00 1.12 H new ATOM 0 HZ3 LYS A 807 1.034 -14.006 2.702 1.00 1.12 H new ATOM 264 N LEU A 808 1.765 -20.205 6.014 1.00 5.01 N ATOM 265 CA LEU A 808 1.248 -20.272 7.370 1.00 30.02 C ATOM 266 C LEU A 808 1.650 -19.005 8.128 1.00 32.10 C ATOM 267 O LEU A 808 2.641 -18.361 7.787 1.00 74.25 O ATOM 268 CB LEU A 808 1.698 -21.566 8.052 1.00 3.51 C ATOM 269 CG LEU A 808 0.891 -22.820 7.711 1.00 12.34 C ATOM 270 CD1 LEU A 808 1.481 -23.539 6.497 1.00 41.41 C ATOM 271 CD2 LEU A 808 0.776 -23.744 8.925 1.00 70.30 C ATOM 0 H LEU A 808 2.770 -20.043 5.948 1.00 5.01 H new ATOM 0 HA LEU A 808 0.159 -20.306 7.361 1.00 30.02 H new ATOM 0 HB2 LEU A 808 2.741 -21.747 7.791 1.00 3.51 H new ATOM 0 HB3 LEU A 808 1.661 -21.416 9.131 1.00 3.51 H new ATOM 0 HG LEU A 808 -0.120 -22.513 7.443 1.00 12.34 H new ATOM 0 HD11 LEU A 808 0.888 -24.427 6.276 1.00 41.41 H new ATOM 0 HD12 LEU A 808 1.468 -22.870 5.636 1.00 41.41 H new ATOM 0 HD13 LEU A 808 2.508 -23.833 6.712 1.00 41.41 H new ATOM 0 HD21 LEU A 808 0.198 -24.628 8.656 1.00 70.30 H new ATOM 0 HD22 LEU A 808 1.772 -24.046 9.248 1.00 70.30 H new ATOM 0 HD23 LEU A 808 0.276 -23.217 9.737 1.00 70.30 H new ATOM 283 N LEU A 809 0.860 -18.685 9.143 1.00 61.44 N ATOM 284 CA LEU A 809 1.121 -17.507 9.952 1.00 41.03 C ATOM 285 C LEU A 809 1.039 -17.882 11.433 1.00 61.13 C ATOM 286 O LEU A 809 0.577 -18.969 11.777 1.00 65.02 O ATOM 287 CB LEU A 809 0.184 -16.365 9.554 1.00 75.34 C ATOM 288 CG LEU A 809 0.740 -15.362 8.541 1.00 24.05 C ATOM 289 CD1 LEU A 809 0.621 -15.900 7.114 1.00 11.41 C ATOM 290 CD2 LEU A 809 0.069 -13.996 8.698 1.00 42.05 C ATOM 0 H LEU A 809 0.039 -19.221 9.423 1.00 61.44 H new ATOM 0 HA LEU A 809 2.131 -17.137 9.772 1.00 41.03 H new ATOM 0 HB2 LEU A 809 -0.729 -16.797 9.144 1.00 75.34 H new ATOM 0 HB3 LEU A 809 -0.098 -15.822 10.456 1.00 75.34 H new ATOM 0 HG LEU A 809 1.802 -15.224 8.744 1.00 24.05 H new ATOM 0 HD11 LEU A 809 1.023 -15.168 6.414 1.00 11.41 H new ATOM 0 HD12 LEU A 809 1.182 -16.830 7.028 1.00 11.41 H new ATOM 0 HD13 LEU A 809 -0.428 -16.086 6.882 1.00 11.41 H new ATOM 0 HD21 LEU A 809 0.482 -13.302 7.966 1.00 42.05 H new ATOM 0 HD22 LEU A 809 -1.004 -14.097 8.537 1.00 42.05 H new ATOM 0 HD23 LEU A 809 0.251 -13.615 9.703 1.00 42.05 H new ATOM 302 N CYS A 810 1.494 -16.961 12.270 1.00 63.34 N ATOM 303 CA CYS A 810 1.478 -17.182 13.706 1.00 42.33 C ATOM 304 C CYS A 810 0.341 -16.353 14.306 1.00 1.23 C ATOM 305 O CYS A 810 0.454 -15.134 14.429 1.00 63.12 O ATOM 306 CB CYS A 810 2.828 -16.847 14.344 1.00 14.15 C ATOM 307 SG CYS A 810 3.345 -18.202 15.461 1.00 51.34 S ATOM 0 H CYS A 810 1.876 -16.060 11.981 1.00 63.34 H new ATOM 0 HA CYS A 810 1.305 -18.238 13.913 1.00 42.33 H new ATOM 0 HB2 CYS A 810 3.579 -16.697 13.568 1.00 14.15 H new ATOM 0 HB3 CYS A 810 2.755 -15.913 14.901 1.00 14.15 H new ATOM 0 HG CYS A 810 4.577 -18.014 15.830 1.00 51.34 H new ATOM 313 N ARG A 811 -0.729 -17.047 14.665 1.00 40.12 N ATOM 314 CA ARG A 811 -1.886 -16.390 15.250 1.00 63.04 C ATOM 315 C ARG A 811 -1.440 -15.328 16.257 1.00 52.13 C ATOM 316 O ARG A 811 -2.154 -14.355 16.495 1.00 52.02 O ATOM 317 CB ARG A 811 -2.795 -17.400 15.952 1.00 14.44 C ATOM 318 CG ARG A 811 -4.037 -16.713 16.524 1.00 34.14 C ATOM 319 CD ARG A 811 -3.833 -16.347 17.996 1.00 42.12 C ATOM 320 NE ARG A 811 -4.607 -15.130 18.327 1.00 33.10 N ATOM 321 CZ ARG A 811 -5.944 -15.111 18.512 1.00 34.13 C ATOM 322 NH1 ARG A 811 -6.668 -16.245 18.400 1.00 21.31 N ATOM 323 NH2 ARG A 811 -6.534 -13.967 18.805 1.00 42.33 N ATOM 0 H ARG A 811 -0.819 -18.058 14.562 1.00 40.12 H new ATOM 0 HA ARG A 811 -2.444 -15.917 14.442 1.00 63.04 H new ATOM 0 HB2 ARG A 811 -3.096 -18.175 15.248 1.00 14.44 H new ATOM 0 HB3 ARG A 811 -2.246 -17.893 16.754 1.00 14.44 H new ATOM 0 HG2 ARG A 811 -4.256 -15.813 15.949 1.00 34.14 H new ATOM 0 HG3 ARG A 811 -4.899 -17.372 16.426 1.00 34.14 H new ATOM 0 HD2 ARG A 811 -4.150 -17.174 18.632 1.00 42.12 H new ATOM 0 HD3 ARG A 811 -2.774 -16.180 18.194 1.00 42.12 H new ATOM 0 HE ARG A 811 -4.099 -14.251 18.421 1.00 33.10 H new ATOM 0 HH11 ARG A 811 -6.205 -17.125 18.174 1.00 21.31 H new ATOM 0 HH12 ARG A 811 -7.678 -16.221 18.541 1.00 21.31 H new ATOM 0 HH21 ARG A 811 -5.980 -13.114 18.889 1.00 42.33 H new ATOM 0 HH22 ARG A 811 -7.543 -13.936 18.948 1.00 42.33 H new ATOM 336 N LYS A 812 -0.262 -15.550 16.821 1.00 73.30 N ATOM 337 CA LYS A 812 0.287 -14.624 17.797 1.00 72.31 C ATOM 338 C LYS A 812 0.034 -13.189 17.331 1.00 71.35 C ATOM 339 O LYS A 812 -0.878 -12.525 17.821 1.00 61.03 O ATOM 340 CB LYS A 812 1.762 -14.935 18.059 1.00 12.23 C ATOM 341 CG LYS A 812 1.936 -16.356 18.598 1.00 75.40 C ATOM 342 CD LYS A 812 2.808 -16.364 19.855 1.00 14.41 C ATOM 343 CE LYS A 812 1.965 -16.120 21.108 1.00 34.05 C ATOM 344 NZ LYS A 812 2.557 -16.813 22.274 1.00 21.13 N ATOM 0 H LYS A 812 0.328 -16.358 16.621 1.00 73.30 H new ATOM 0 HA LYS A 812 -0.215 -14.740 18.757 1.00 72.31 H new ATOM 0 HB2 LYS A 812 2.331 -14.820 17.136 1.00 12.23 H new ATOM 0 HB3 LYS A 812 2.167 -14.219 18.774 1.00 12.23 H new ATOM 0 HG2 LYS A 812 0.960 -16.784 18.826 1.00 75.40 H new ATOM 0 HG3 LYS A 812 2.390 -16.986 17.833 1.00 75.40 H new ATOM 0 HD2 LYS A 812 3.322 -17.321 19.939 1.00 14.41 H new ATOM 0 HD3 LYS A 812 3.576 -15.595 19.774 1.00 14.41 H new ATOM 0 HE2 LYS A 812 1.900 -15.050 21.307 1.00 34.05 H new ATOM 0 HE3 LYS A 812 0.948 -16.476 20.944 1.00 34.05 H new ATOM 0 HZ1 LYS A 812 1.972 -16.637 23.116 1.00 21.13 H new ATOM 0 HZ2 LYS A 812 2.596 -17.835 22.087 1.00 21.13 H new ATOM 0 HZ3 LYS A 812 3.519 -16.454 22.439 1.00 21.13 H new ATOM 357 N CYS A 813 0.858 -12.753 16.389 1.00 74.22 N ATOM 358 CA CYS A 813 0.735 -11.409 15.851 1.00 73.13 C ATOM 359 C CYS A 813 0.404 -11.516 14.361 1.00 71.51 C ATOM 360 O CYS A 813 0.558 -10.550 13.616 1.00 42.11 O ATOM 361 CB CYS A 813 1.999 -10.584 16.097 1.00 42.44 C ATOM 362 SG CYS A 813 2.606 -10.861 17.800 1.00 25.44 S ATOM 0 H CYS A 813 1.613 -13.307 15.985 1.00 74.22 H new ATOM 0 HA CYS A 813 -0.070 -10.882 16.364 1.00 73.13 H new ATOM 0 HB2 CYS A 813 2.770 -10.861 15.378 1.00 42.44 H new ATOM 0 HB3 CYS A 813 1.788 -9.526 15.945 1.00 42.44 H new ATOM 0 HG CYS A 813 3.681 -10.157 17.997 1.00 25.44 H new ATOM 368 N LYS A 814 -0.045 -12.700 13.971 1.00 61.42 N ATOM 369 CA LYS A 814 -0.399 -12.947 12.583 1.00 2.42 C ATOM 370 C LYS A 814 0.796 -12.610 11.689 1.00 25.32 C ATOM 371 O LYS A 814 0.762 -11.634 10.942 1.00 0.21 O ATOM 372 CB LYS A 814 -1.676 -12.189 12.213 1.00 23.24 C ATOM 373 CG LYS A 814 -2.647 -12.142 13.395 1.00 44.20 C ATOM 374 CD LYS A 814 -2.910 -13.545 13.945 1.00 74.14 C ATOM 375 CE LYS A 814 -3.668 -14.399 12.926 1.00 34.24 C ATOM 376 NZ LYS A 814 -2.721 -15.154 12.075 1.00 13.43 N ATOM 0 H LYS A 814 -0.172 -13.499 14.592 1.00 61.42 H new ATOM 0 HA LYS A 814 -0.626 -14.002 12.430 1.00 2.42 H new ATOM 0 HB2 LYS A 814 -1.424 -11.175 11.904 1.00 23.24 H new ATOM 0 HB3 LYS A 814 -2.156 -12.672 11.362 1.00 23.24 H new ATOM 0 HG2 LYS A 814 -2.236 -11.510 14.182 1.00 44.20 H new ATOM 0 HG3 LYS A 814 -3.587 -11.689 13.080 1.00 44.20 H new ATOM 0 HD2 LYS A 814 -1.964 -14.025 14.195 1.00 74.14 H new ATOM 0 HD3 LYS A 814 -3.486 -13.476 14.868 1.00 74.14 H new ATOM 0 HE2 LYS A 814 -4.331 -15.091 13.445 1.00 34.24 H new ATOM 0 HE3 LYS A 814 -4.296 -13.761 12.304 1.00 34.24 H new ATOM 0 HZ1 LYS A 814 -3.217 -15.949 11.624 1.00 13.43 H new ATOM 0 HZ2 LYS A 814 -2.336 -14.525 11.342 1.00 13.43 H new ATOM 0 HZ3 LYS A 814 -1.943 -15.520 12.661 1.00 13.43 H new ATOM 389 N ALA A 815 1.825 -13.438 11.795 1.00 24.22 N ATOM 390 CA ALA A 815 3.029 -13.241 11.006 1.00 42.24 C ATOM 391 C ALA A 815 3.495 -14.588 10.449 1.00 42.41 C ATOM 392 O ALA A 815 3.370 -15.615 11.114 1.00 43.13 O ATOM 393 CB ALA A 815 4.099 -12.564 11.865 1.00 15.23 C ATOM 0 H ALA A 815 1.850 -14.247 12.416 1.00 24.22 H new ATOM 0 HA ALA A 815 2.829 -12.585 10.159 1.00 42.24 H new ATOM 0 HB1 ALA A 815 5.002 -12.417 11.272 1.00 15.23 H new ATOM 0 HB2 ALA A 815 3.730 -11.598 12.211 1.00 15.23 H new ATOM 0 HB3 ALA A 815 4.328 -13.194 12.724 1.00 15.23 H new ATOM 399 N LEU A 816 4.023 -14.539 9.234 1.00 33.25 N ATOM 400 CA LEU A 816 4.508 -15.743 8.581 1.00 50.32 C ATOM 401 C LEU A 816 5.223 -16.623 9.608 1.00 50.21 C ATOM 402 O LEU A 816 6.007 -16.128 10.416 1.00 11.13 O ATOM 403 CB LEU A 816 5.373 -15.384 7.371 1.00 55.44 C ATOM 404 CG LEU A 816 6.184 -16.529 6.762 1.00 21.35 C ATOM 405 CD1 LEU A 816 7.372 -16.893 7.655 1.00 64.34 C ATOM 406 CD2 LEU A 816 5.293 -17.739 6.473 1.00 41.12 C ATOM 0 H LEU A 816 4.125 -13.685 8.686 1.00 33.25 H new ATOM 0 HA LEU A 816 3.675 -16.325 8.188 1.00 50.32 H new ATOM 0 HB2 LEU A 816 4.726 -14.972 6.597 1.00 55.44 H new ATOM 0 HB3 LEU A 816 6.063 -14.593 7.665 1.00 55.44 H new ATOM 0 HG LEU A 816 6.589 -16.192 5.808 1.00 21.35 H new ATOM 0 HD11 LEU A 816 7.933 -17.710 7.200 1.00 64.34 H new ATOM 0 HD12 LEU A 816 8.022 -16.025 7.768 1.00 64.34 H new ATOM 0 HD13 LEU A 816 7.009 -17.204 8.635 1.00 64.34 H new ATOM 0 HD21 LEU A 816 5.894 -18.539 6.041 1.00 41.12 H new ATOM 0 HD22 LEU A 816 4.840 -18.087 7.401 1.00 41.12 H new ATOM 0 HD23 LEU A 816 4.509 -17.454 5.771 1.00 41.12 H new ATOM 418 N ALA A 817 4.927 -17.913 9.543 1.00 50.41 N ATOM 419 CA ALA A 817 5.532 -18.866 10.457 1.00 33.32 C ATOM 420 C ALA A 817 6.272 -19.937 9.654 1.00 62.41 C ATOM 421 O ALA A 817 7.384 -20.326 10.008 1.00 22.11 O ATOM 422 CB ALA A 817 4.452 -19.460 11.364 1.00 74.13 C ATOM 0 H ALA A 817 4.276 -18.320 8.871 1.00 50.41 H new ATOM 0 HA ALA A 817 6.262 -18.372 11.099 1.00 33.32 H new ATOM 0 HB1 ALA A 817 4.906 -20.175 12.050 1.00 74.13 H new ATOM 0 HB2 ALA A 817 3.976 -18.662 11.934 1.00 74.13 H new ATOM 0 HB3 ALA A 817 3.703 -19.966 10.755 1.00 74.13 H new ATOM 428 N CYS A 818 5.626 -20.384 8.587 1.00 32.12 N ATOM 429 CA CYS A 818 6.209 -21.403 7.731 1.00 41.43 C ATOM 430 C CYS A 818 5.251 -21.657 6.566 1.00 74.32 C ATOM 431 O CYS A 818 4.258 -20.948 6.408 1.00 70.33 O ATOM 432 CB CYS A 818 6.518 -22.685 8.506 1.00 2.23 C ATOM 433 SG CYS A 818 5.082 -23.152 9.540 1.00 63.41 S ATOM 0 H CYS A 818 4.704 -20.059 8.296 1.00 32.12 H new ATOM 0 HA CYS A 818 7.166 -21.052 7.344 1.00 41.43 H new ATOM 0 HB2 CYS A 818 6.754 -23.491 7.812 1.00 2.23 H new ATOM 0 HB3 CYS A 818 7.396 -22.537 9.134 1.00 2.23 H new ATOM 0 HG CYS A 818 5.354 -24.243 10.193 1.00 63.41 H new ATOM 439 N TYR A 819 5.581 -22.672 5.780 1.00 2.40 N ATOM 440 CA TYR A 819 4.762 -23.029 4.634 1.00 11.43 C ATOM 441 C TYR A 819 4.380 -24.510 4.673 1.00 1.25 C ATOM 442 O TYR A 819 5.163 -25.345 5.124 1.00 10.42 O ATOM 443 CB TYR A 819 5.628 -22.770 3.400 1.00 51.02 C ATOM 444 CG TYR A 819 5.846 -21.287 3.093 1.00 65.23 C ATOM 445 CD1 TYR A 819 6.920 -20.619 3.646 1.00 41.14 C ATOM 446 CD2 TYR A 819 4.970 -20.618 2.263 1.00 42.12 C ATOM 447 CE1 TYR A 819 7.126 -19.223 3.357 1.00 71.34 C ATOM 448 CE2 TYR A 819 5.176 -19.222 1.974 1.00 60.33 C ATOM 449 CZ TYR A 819 6.244 -18.594 2.535 1.00 53.11 C ATOM 450 OH TYR A 819 6.438 -17.276 2.262 1.00 41.21 O ATOM 0 H TYR A 819 6.405 -23.258 5.915 1.00 2.40 H new ATOM 0 HA TYR A 819 3.839 -22.449 4.626 1.00 11.43 H new ATOM 0 HB2 TYR A 819 6.598 -23.247 3.542 1.00 51.02 H new ATOM 0 HB3 TYR A 819 5.163 -23.245 2.536 1.00 51.02 H new ATOM 0 HD1 TYR A 819 7.606 -21.143 4.295 1.00 41.14 H new ATOM 0 HD2 TYR A 819 4.130 -21.141 1.830 1.00 42.12 H new ATOM 0 HE1 TYR A 819 7.962 -18.688 3.783 1.00 71.34 H new ATOM 0 HE2 TYR A 819 4.498 -18.686 1.327 1.00 60.33 H new ATOM 0 HH TYR A 819 5.732 -16.959 1.661 1.00 41.21 H new ATOM 460 N THR A 820 3.177 -24.791 4.195 1.00 11.43 N ATOM 461 CA THR A 820 2.682 -26.156 4.170 1.00 73.50 C ATOM 462 C THR A 820 3.584 -27.035 3.302 1.00 44.03 C ATOM 463 O THR A 820 3.650 -28.248 3.497 1.00 52.35 O ATOM 464 CB THR A 820 1.228 -26.123 3.695 1.00 34.43 C ATOM 465 OG1 THR A 820 0.594 -27.155 4.447 1.00 55.21 O ATOM 466 CG2 THR A 820 1.076 -26.575 2.241 1.00 12.13 C ATOM 0 H THR A 820 2.530 -24.096 3.822 1.00 11.43 H new ATOM 0 HA THR A 820 2.705 -26.603 5.164 1.00 73.50 H new ATOM 0 HB THR A 820 0.834 -25.113 3.804 1.00 34.43 H new ATOM 0 HG1 THR A 820 0.153 -26.765 5.231 1.00 55.21 H new ATOM 0 HG21 THR A 820 0.025 -26.533 1.955 1.00 12.13 H new ATOM 0 HG22 THR A 820 1.655 -25.917 1.593 1.00 12.13 H new ATOM 0 HG23 THR A 820 1.439 -27.598 2.138 1.00 12.13 H new ATOM 474 N ALA A 821 4.258 -26.389 2.362 1.00 42.43 N ATOM 475 CA ALA A 821 5.154 -27.096 1.463 1.00 44.21 C ATOM 476 C ALA A 821 6.364 -27.604 2.251 1.00 53.33 C ATOM 477 O ALA A 821 7.158 -28.390 1.737 1.00 31.11 O ATOM 478 CB ALA A 821 5.555 -26.173 0.311 1.00 42.44 C ATOM 0 H ALA A 821 4.201 -25.383 2.203 1.00 42.43 H new ATOM 0 HA ALA A 821 4.656 -27.962 1.028 1.00 44.21 H new ATOM 0 HB1 ALA A 821 6.227 -26.704 -0.363 1.00 42.44 H new ATOM 0 HB2 ALA A 821 4.664 -25.864 -0.235 1.00 42.44 H new ATOM 0 HB3 ALA A 821 6.060 -25.293 0.709 1.00 42.44 H new ATOM 484 N ASP A 822 6.465 -27.133 3.485 1.00 23.52 N ATOM 485 CA ASP A 822 7.564 -27.530 4.349 1.00 63.20 C ATOM 486 C ASP A 822 7.015 -28.333 5.530 1.00 70.22 C ATOM 487 O ASP A 822 7.729 -29.142 6.121 1.00 11.31 O ATOM 488 CB ASP A 822 8.295 -26.307 4.908 1.00 73.53 C ATOM 489 CG ASP A 822 9.302 -25.664 3.953 1.00 41.21 C ATOM 490 OD1 ASP A 822 9.819 -26.317 3.034 1.00 20.15 O ATOM 491 OD2 ASP A 822 9.555 -24.420 4.185 1.00 61.24 O ATOM 0 H ASP A 822 5.804 -26.481 3.907 1.00 23.52 H new ATOM 0 HA ASP A 822 8.259 -28.127 3.758 1.00 63.20 H new ATOM 0 HB2 ASP A 822 7.555 -25.558 5.190 1.00 73.53 H new ATOM 0 HB3 ASP A 822 8.817 -26.599 5.819 1.00 73.53 H new ATOM 497 N VAL A 823 5.751 -28.082 5.838 1.00 60.21 N ATOM 498 CA VAL A 823 5.098 -28.772 6.937 1.00 13.34 C ATOM 499 C VAL A 823 4.817 -30.220 6.531 1.00 51.31 C ATOM 500 O VAL A 823 4.150 -30.468 5.527 1.00 23.45 O ATOM 501 CB VAL A 823 3.837 -28.013 7.355 1.00 15.14 C ATOM 502 CG1 VAL A 823 2.618 -28.500 6.569 1.00 33.14 C ATOM 503 CG2 VAL A 823 3.600 -28.130 8.862 1.00 22.55 C ATOM 0 H VAL A 823 5.162 -27.410 5.346 1.00 60.21 H new ATOM 0 HA VAL A 823 5.749 -28.801 7.810 1.00 13.34 H new ATOM 0 HB VAL A 823 3.988 -26.959 7.121 1.00 15.14 H new ATOM 0 HG11 VAL A 823 1.735 -27.944 6.885 1.00 33.14 H new ATOM 0 HG12 VAL A 823 2.785 -28.341 5.504 1.00 33.14 H new ATOM 0 HG13 VAL A 823 2.465 -29.563 6.757 1.00 33.14 H new ATOM 0 HG21 VAL A 823 2.698 -27.582 9.132 1.00 22.55 H new ATOM 0 HG22 VAL A 823 3.481 -29.180 9.131 1.00 22.55 H new ATOM 0 HG23 VAL A 823 4.452 -27.712 9.398 1.00 22.55 H new ATOM 513 N ARG A 824 5.340 -31.137 7.331 1.00 74.31 N ATOM 514 CA ARG A 824 5.154 -32.554 7.067 1.00 74.11 C ATOM 515 C ARG A 824 4.989 -33.322 8.380 1.00 14.52 C ATOM 516 O ARG A 824 5.889 -33.326 9.218 1.00 0.32 O ATOM 517 CB ARG A 824 6.341 -33.131 6.293 1.00 52.40 C ATOM 518 CG ARG A 824 6.083 -33.093 4.785 1.00 11.33 C ATOM 519 CD ARG A 824 6.684 -31.834 4.158 1.00 41.53 C ATOM 520 NE ARG A 824 6.589 -31.909 2.683 1.00 45.43 N ATOM 521 CZ ARG A 824 7.396 -32.667 1.910 1.00 33.21 C ATOM 522 NH1 ARG A 824 8.365 -33.424 2.467 1.00 2.44 N ATOM 523 NH2 ARG A 824 7.222 -32.658 0.602 1.00 61.24 N ATOM 0 H ARG A 824 5.892 -30.927 8.162 1.00 74.31 H new ATOM 0 HA ARG A 824 4.253 -32.663 6.463 1.00 74.11 H new ATOM 0 HB2 ARG A 824 7.242 -32.563 6.526 1.00 52.40 H new ATOM 0 HB3 ARG A 824 6.521 -34.159 6.609 1.00 52.40 H new ATOM 0 HG2 ARG A 824 6.513 -33.978 4.316 1.00 11.33 H new ATOM 0 HG3 ARG A 824 5.010 -33.122 4.595 1.00 11.33 H new ATOM 0 HD2 ARG A 824 6.158 -30.951 4.520 1.00 41.53 H new ATOM 0 HD3 ARG A 824 7.726 -31.730 4.459 1.00 41.53 H new ATOM 0 HE ARG A 824 5.869 -31.353 2.221 1.00 45.43 H new ATOM 0 HH11 ARG A 824 8.492 -33.426 3.479 1.00 2.44 H new ATOM 0 HH12 ARG A 824 8.970 -33.994 1.876 1.00 2.44 H new ATOM 0 HH21 ARG A 824 6.487 -32.084 0.189 1.00 61.24 H new ATOM 0 HH22 ARG A 824 7.823 -33.225 0.004 1.00 61.24 H new ATOM 536 N VAL A 825 3.832 -33.952 8.519 1.00 72.44 N ATOM 537 CA VAL A 825 3.537 -34.722 9.716 1.00 43.53 C ATOM 538 C VAL A 825 4.302 -36.046 9.667 1.00 54.04 C ATOM 539 O VAL A 825 4.502 -36.611 8.593 1.00 65.42 O ATOM 540 CB VAL A 825 2.025 -34.909 9.859 1.00 45.33 C ATOM 541 CG1 VAL A 825 1.357 -33.622 10.347 1.00 45.21 C ATOM 542 CG2 VAL A 825 1.405 -35.384 8.543 1.00 0.23 C ATOM 0 H VAL A 825 3.087 -33.945 7.822 1.00 72.44 H new ATOM 0 HA VAL A 825 3.870 -34.187 10.606 1.00 43.53 H new ATOM 0 HB VAL A 825 1.852 -35.681 10.609 1.00 45.33 H new ATOM 0 HG11 VAL A 825 0.283 -33.782 10.440 1.00 45.21 H new ATOM 0 HG12 VAL A 825 1.768 -33.344 11.318 1.00 45.21 H new ATOM 0 HG13 VAL A 825 1.544 -32.821 9.631 1.00 45.21 H new ATOM 0 HG21 VAL A 825 0.330 -35.509 8.672 1.00 0.23 H new ATOM 0 HG22 VAL A 825 1.594 -34.645 7.764 1.00 0.23 H new ATOM 0 HG23 VAL A 825 1.849 -36.337 8.254 1.00 0.23 H new ATOM 552 N ILE A 826 4.707 -36.502 10.842 1.00 22.34 N ATOM 553 CA ILE A 826 5.445 -37.750 10.947 1.00 0.31 C ATOM 554 C ILE A 826 4.458 -38.913 11.061 1.00 31.12 C ATOM 555 O ILE A 826 4.162 -39.375 12.162 1.00 23.41 O ATOM 556 CB ILE A 826 6.451 -37.682 12.098 1.00 64.05 C ATOM 557 CG1 ILE A 826 7.739 -36.980 11.659 1.00 35.25 C ATOM 558 CG2 ILE A 826 6.724 -39.074 12.670 1.00 21.41 C ATOM 559 CD1 ILE A 826 8.262 -36.056 12.761 1.00 34.53 C ATOM 0 H ILE A 826 4.538 -36.030 11.730 1.00 22.34 H new ATOM 0 HA ILE A 826 6.036 -37.920 10.047 1.00 0.31 H new ATOM 0 HB ILE A 826 6.015 -37.085 12.899 1.00 64.05 H new ATOM 0 HG12 ILE A 826 8.497 -37.724 11.413 1.00 35.25 H new ATOM 0 HG13 ILE A 826 7.552 -36.403 10.753 1.00 35.25 H new ATOM 0 HG21 ILE A 826 7.442 -38.997 13.486 1.00 21.41 H new ATOM 0 HG22 ILE A 826 5.794 -39.503 13.044 1.00 21.41 H new ATOM 0 HG23 ILE A 826 7.131 -39.715 11.888 1.00 21.41 H new ATOM 0 HD11 ILE A 826 9.177 -35.570 12.424 1.00 34.53 H new ATOM 0 HD12 ILE A 826 7.511 -35.299 12.988 1.00 34.53 H new ATOM 0 HD13 ILE A 826 8.470 -36.640 13.657 1.00 34.53 H new ATOM 571 N GLU A 827 3.975 -39.353 9.908 1.00 2.04 N ATOM 572 CA GLU A 827 3.028 -40.454 9.865 1.00 15.40 C ATOM 573 C GLU A 827 1.790 -40.122 10.702 1.00 42.13 C ATOM 574 O GLU A 827 1.155 -41.016 11.258 1.00 73.20 O ATOM 575 CB GLU A 827 3.677 -41.755 10.339 1.00 71.32 C ATOM 576 CG GLU A 827 4.927 -42.075 9.517 1.00 4.02 C ATOM 577 CD GLU A 827 5.669 -43.282 10.095 1.00 3.10 C ATOM 578 OE1 GLU A 827 6.705 -43.115 10.756 1.00 43.43 O ATOM 579 OE2 GLU A 827 5.133 -44.426 9.838 1.00 74.34 O ATOM 0 H GLU A 827 4.222 -38.967 8.997 1.00 2.04 H new ATOM 0 HA GLU A 827 2.716 -40.599 8.831 1.00 15.40 H new ATOM 0 HB2 GLU A 827 3.942 -41.670 11.393 1.00 71.32 H new ATOM 0 HB3 GLU A 827 2.962 -42.574 10.255 1.00 71.32 H new ATOM 0 HG2 GLU A 827 4.645 -42.277 8.484 1.00 4.02 H new ATOM 0 HG3 GLU A 827 5.589 -41.209 9.503 1.00 4.02 H new ATOM 587 N GLU A 828 1.485 -38.834 10.764 1.00 24.14 N ATOM 588 CA GLU A 828 0.335 -38.373 11.524 1.00 64.31 C ATOM 589 C GLU A 828 0.572 -38.577 13.022 1.00 62.24 C ATOM 590 O GLU A 828 -0.305 -39.068 13.731 1.00 25.11 O ATOM 591 CB GLU A 828 -0.942 -39.082 11.069 1.00 22.42 C ATOM 592 CG GLU A 828 -1.130 -38.956 9.556 1.00 30.10 C ATOM 593 CD GLU A 828 -2.455 -39.581 9.114 1.00 0.04 C ATOM 594 OE1 GLU A 828 -2.455 -40.593 8.397 1.00 2.53 O ATOM 595 OE2 GLU A 828 -3.512 -38.979 9.544 1.00 42.41 O ATOM 0 H GLU A 828 2.014 -38.095 10.301 1.00 24.14 H new ATOM 0 HA GLU A 828 0.205 -37.307 11.339 1.00 64.31 H new ATOM 0 HB2 GLU A 828 -0.896 -40.135 11.347 1.00 22.42 H new ATOM 0 HB3 GLU A 828 -1.803 -38.654 11.583 1.00 22.42 H new ATOM 0 HG2 GLU A 828 -1.106 -37.905 9.269 1.00 30.10 H new ATOM 0 HG3 GLU A 828 -0.303 -39.446 9.041 1.00 30.10 H new ATOM 603 N CYS A 829 1.762 -38.190 13.458 1.00 15.24 N ATOM 604 CA CYS A 829 2.125 -38.324 14.859 1.00 54.11 C ATOM 605 C CYS A 829 2.309 -36.922 15.444 1.00 75.21 C ATOM 606 O CYS A 829 1.916 -36.664 16.580 1.00 14.44 O ATOM 607 CB CYS A 829 3.376 -39.186 15.039 1.00 74.21 C ATOM 608 SG CYS A 829 3.344 -40.001 16.677 1.00 34.11 S ATOM 0 H CYS A 829 2.487 -37.784 12.866 1.00 15.24 H new ATOM 0 HA CYS A 829 1.328 -38.839 15.396 1.00 54.11 H new ATOM 0 HB2 CYS A 829 3.427 -39.937 14.251 1.00 74.21 H new ATOM 0 HB3 CYS A 829 4.269 -38.568 14.948 1.00 74.21 H new ATOM 0 HG CYS A 829 4.410 -40.732 16.819 1.00 34.11 H new ATOM 614 N HIS A 830 2.906 -36.054 14.641 1.00 70.33 N ATOM 615 CA HIS A 830 3.147 -34.685 15.065 1.00 72.44 C ATOM 616 C HIS A 830 3.299 -33.787 13.836 1.00 42.04 C ATOM 617 O HIS A 830 3.503 -34.276 12.726 1.00 62.43 O ATOM 618 CB HIS A 830 4.351 -34.612 16.006 1.00 73.02 C ATOM 619 CG HIS A 830 4.059 -35.075 17.413 1.00 30.13 C ATOM 620 ND1 HIS A 830 4.616 -36.220 17.957 1.00 40.45 N ATOM 621 CD2 HIS A 830 3.265 -34.536 18.382 1.00 33.02 C ATOM 622 CE1 HIS A 830 4.169 -36.354 19.197 1.00 64.14 C ATOM 623 NE2 HIS A 830 3.332 -35.310 19.458 1.00 34.03 N ATOM 0 H HIS A 830 3.230 -36.272 13.699 1.00 70.33 H new ATOM 0 HA HIS A 830 2.292 -34.320 15.635 1.00 72.44 H new ATOM 0 HB2 HIS A 830 5.158 -35.219 15.595 1.00 73.02 H new ATOM 0 HB3 HIS A 830 4.711 -33.584 16.040 1.00 73.02 H new ATOM 0 HD2 HIS A 830 2.681 -33.632 18.289 1.00 33.02 H new ATOM 0 HE1 HIS A 830 4.423 -37.150 19.881 1.00 64.14 H new ATOM 0 HE2 HIS A 830 2.838 -35.150 20.336 1.00 34.03 H new ATOM 631 N TYR A 831 3.194 -32.488 14.075 1.00 24.22 N ATOM 632 CA TYR A 831 3.318 -31.517 13.002 1.00 41.42 C ATOM 633 C TYR A 831 4.695 -30.850 13.022 1.00 50.23 C ATOM 634 O TYR A 831 4.947 -29.963 13.836 1.00 65.10 O ATOM 635 CB TYR A 831 2.247 -30.457 13.267 1.00 3.51 C ATOM 636 CG TYR A 831 0.881 -30.787 12.663 1.00 21.42 C ATOM 637 CD1 TYR A 831 0.679 -30.663 11.304 1.00 41.25 C ATOM 638 CD2 TYR A 831 -0.149 -31.210 13.478 1.00 75.31 C ATOM 639 CE1 TYR A 831 -0.607 -30.974 10.735 1.00 22.21 C ATOM 640 CE2 TYR A 831 -1.435 -31.522 12.909 1.00 13.34 C ATOM 641 CZ TYR A 831 -1.601 -31.388 11.566 1.00 25.31 C ATOM 642 OH TYR A 831 -2.815 -31.682 11.029 1.00 20.42 O ATOM 0 H TYR A 831 3.024 -32.085 14.997 1.00 24.22 H new ATOM 0 HA TYR A 831 3.198 -32.000 12.032 1.00 41.42 H new ATOM 0 HB2 TYR A 831 2.135 -30.330 14.344 1.00 3.51 H new ATOM 0 HB3 TYR A 831 2.589 -29.502 12.867 1.00 3.51 H new ATOM 0 HD1 TYR A 831 1.486 -30.333 10.666 1.00 41.25 H new ATOM 0 HD2 TYR A 831 0.009 -31.307 14.542 1.00 75.31 H new ATOM 0 HE1 TYR A 831 -0.778 -30.881 9.673 1.00 22.21 H new ATOM 0 HE2 TYR A 831 -2.249 -31.855 13.535 1.00 13.34 H new ATOM 0 HH TYR A 831 -3.109 -32.561 11.347 1.00 20.42 H new ATOM 652 N THR A 832 5.549 -31.302 12.116 1.00 63.13 N ATOM 653 CA THR A 832 6.894 -30.760 12.019 1.00 21.30 C ATOM 654 C THR A 832 7.220 -30.398 10.569 1.00 62.43 C ATOM 655 O THR A 832 6.844 -31.119 9.646 1.00 70.14 O ATOM 656 CB THR A 832 7.860 -31.782 12.622 1.00 30.21 C ATOM 657 OG1 THR A 832 7.972 -32.788 11.619 1.00 32.22 O ATOM 658 CG2 THR A 832 7.260 -32.518 13.822 1.00 1.43 C ATOM 0 H THR A 832 5.336 -32.038 11.442 1.00 63.13 H new ATOM 0 HA THR A 832 6.988 -29.831 12.582 1.00 21.30 H new ATOM 0 HB THR A 832 8.777 -31.278 12.927 1.00 30.21 H new ATOM 0 HG1 THR A 832 8.879 -32.780 11.247 1.00 32.22 H new ATOM 0 HG21 THR A 832 7.986 -33.231 14.212 1.00 1.43 H new ATOM 0 HG22 THR A 832 7.005 -31.798 14.600 1.00 1.43 H new ATOM 0 HG23 THR A 832 6.361 -33.050 13.510 1.00 1.43 H new ATOM 666 N VAL A 833 7.917 -29.282 10.413 1.00 15.03 N ATOM 667 CA VAL A 833 8.298 -28.816 9.091 1.00 55.51 C ATOM 668 C VAL A 833 9.816 -28.921 8.936 1.00 50.23 C ATOM 669 O VAL A 833 10.529 -29.148 9.912 1.00 41.32 O ATOM 670 CB VAL A 833 7.770 -27.397 8.864 1.00 22.23 C ATOM 671 CG1 VAL A 833 6.405 -27.207 9.529 1.00 62.14 C ATOM 672 CG2 VAL A 833 8.772 -26.354 9.362 1.00 45.32 C ATOM 0 H VAL A 833 8.228 -28.687 11.181 1.00 15.03 H new ATOM 0 HA VAL A 833 7.849 -29.443 8.321 1.00 55.51 H new ATOM 0 HB VAL A 833 7.643 -27.254 7.791 1.00 22.23 H new ATOM 0 HG11 VAL A 833 6.053 -26.191 9.353 1.00 62.14 H new ATOM 0 HG12 VAL A 833 5.693 -27.916 9.107 1.00 62.14 H new ATOM 0 HG13 VAL A 833 6.496 -27.378 10.602 1.00 62.14 H new ATOM 0 HG21 VAL A 833 8.373 -25.355 9.189 1.00 45.32 H new ATOM 0 HG22 VAL A 833 8.945 -26.496 10.429 1.00 45.32 H new ATOM 0 HG23 VAL A 833 9.713 -26.467 8.823 1.00 45.32 H new ATOM 682 N LEU A 834 10.266 -28.751 7.701 1.00 13.21 N ATOM 683 CA LEU A 834 11.686 -28.824 7.405 1.00 4.14 C ATOM 684 C LEU A 834 12.120 -27.544 6.688 1.00 2.34 C ATOM 685 O LEU A 834 11.281 -26.757 6.253 1.00 12.01 O ATOM 686 CB LEU A 834 12.007 -30.103 6.629 1.00 41.52 C ATOM 687 CG LEU A 834 11.202 -31.344 7.019 1.00 50.23 C ATOM 688 CD1 LEU A 834 9.832 -31.345 6.338 1.00 60.03 C ATOM 689 CD2 LEU A 834 11.989 -32.622 6.725 1.00 22.51 C ATOM 0 H LEU A 834 9.671 -28.563 6.894 1.00 13.21 H new ATOM 0 HA LEU A 834 12.264 -28.885 8.327 1.00 4.14 H new ATOM 0 HB2 LEU A 834 11.848 -29.910 5.568 1.00 41.52 H new ATOM 0 HB3 LEU A 834 13.066 -30.326 6.758 1.00 41.52 H new ATOM 0 HG LEU A 834 11.027 -31.314 8.094 1.00 50.23 H new ATOM 0 HD11 LEU A 834 9.280 -32.238 6.632 1.00 60.03 H new ATOM 0 HD12 LEU A 834 9.275 -30.458 6.640 1.00 60.03 H new ATOM 0 HD13 LEU A 834 9.964 -31.340 5.256 1.00 60.03 H new ATOM 0 HD21 LEU A 834 11.394 -33.489 7.011 1.00 22.51 H new ATOM 0 HD22 LEU A 834 12.216 -32.673 5.660 1.00 22.51 H new ATOM 0 HD23 LEU A 834 12.919 -32.616 7.294 1.00 22.51 H new ATOM 701 N GLY A 835 13.430 -27.375 6.588 1.00 44.13 N ATOM 702 CA GLY A 835 13.986 -26.204 5.931 1.00 12.30 C ATOM 703 C GLY A 835 14.749 -25.327 6.926 1.00 33.13 C ATOM 704 O GLY A 835 14.335 -25.182 8.075 1.00 14.43 O ATOM 0 H GLY A 835 14.123 -28.030 6.951 1.00 44.13 H new ATOM 0 HA2 GLY A 835 14.655 -26.516 5.129 1.00 12.30 H new ATOM 0 HA3 GLY A 835 13.185 -25.626 5.471 1.00 12.30 H new ATOM 708 N ASP A 836 15.850 -24.766 6.449 1.00 53.23 N ATOM 709 CA ASP A 836 16.674 -23.907 7.282 1.00 23.42 C ATOM 710 C ASP A 836 16.085 -22.495 7.292 1.00 23.42 C ATOM 711 O ASP A 836 16.471 -21.664 8.113 1.00 53.03 O ATOM 712 CB ASP A 836 18.102 -23.820 6.740 1.00 62.20 C ATOM 713 CG ASP A 836 18.223 -23.250 5.326 1.00 41.45 C ATOM 714 OD1 ASP A 836 18.869 -22.214 5.108 1.00 41.22 O ATOM 715 OD2 ASP A 836 17.611 -23.924 4.412 1.00 50.44 O ATOM 0 H ASP A 836 16.191 -24.890 5.496 1.00 53.23 H new ATOM 0 HA ASP A 836 16.694 -24.331 8.286 1.00 23.42 H new ATOM 0 HB2 ASP A 836 18.694 -23.203 7.416 1.00 62.20 H new ATOM 0 HB3 ASP A 836 18.541 -24.818 6.752 1.00 62.20 H new ATOM 721 N ALA A 837 15.161 -22.268 6.371 1.00 51.22 N ATOM 722 CA ALA A 837 14.515 -20.971 6.263 1.00 11.32 C ATOM 723 C ALA A 837 13.850 -20.625 7.597 1.00 1.40 C ATOM 724 O ALA A 837 13.909 -19.481 8.046 1.00 51.23 O ATOM 725 CB ALA A 837 13.518 -20.991 5.103 1.00 72.41 C ATOM 0 H ALA A 837 14.844 -22.960 5.692 1.00 51.22 H new ATOM 0 HA ALA A 837 15.249 -20.194 6.048 1.00 11.32 H new ATOM 0 HB1 ALA A 837 13.034 -20.018 5.023 1.00 72.41 H new ATOM 0 HB2 ALA A 837 14.044 -21.212 4.175 1.00 72.41 H new ATOM 0 HB3 ALA A 837 12.764 -21.757 5.284 1.00 72.41 H new ATOM 731 N PHE A 838 13.233 -21.634 8.194 1.00 51.14 N ATOM 732 CA PHE A 838 12.558 -21.451 9.467 1.00 12.31 C ATOM 733 C PHE A 838 13.531 -21.628 10.634 1.00 20.43 C ATOM 734 O PHE A 838 13.264 -21.172 11.745 1.00 70.01 O ATOM 735 CB PHE A 838 11.472 -22.525 9.556 1.00 12.31 C ATOM 736 CG PHE A 838 11.974 -23.877 10.065 1.00 25.15 C ATOM 737 CD1 PHE A 838 12.328 -24.023 11.371 1.00 62.54 C ATOM 738 CD2 PHE A 838 12.068 -24.933 9.213 1.00 14.22 C ATOM 739 CE1 PHE A 838 12.795 -25.279 11.843 1.00 13.52 C ATOM 740 CE2 PHE A 838 12.534 -26.188 9.686 1.00 42.11 C ATOM 741 CZ PHE A 838 12.888 -26.334 10.991 1.00 31.30 C ATOM 0 H PHE A 838 13.187 -22.581 7.819 1.00 51.14 H new ATOM 0 HA PHE A 838 12.141 -20.445 9.526 1.00 12.31 H new ATOM 0 HB2 PHE A 838 10.679 -22.172 10.215 1.00 12.31 H new ATOM 0 HB3 PHE A 838 11.029 -22.662 8.570 1.00 12.31 H new ATOM 0 HD1 PHE A 838 12.254 -23.185 12.048 1.00 62.54 H new ATOM 0 HD2 PHE A 838 11.788 -24.817 8.176 1.00 14.22 H new ATOM 0 HE1 PHE A 838 13.076 -25.396 12.879 1.00 13.52 H new ATOM 0 HE2 PHE A 838 12.607 -27.027 9.009 1.00 42.11 H new ATOM 0 HZ PHE A 838 13.243 -27.289 11.350 1.00 31.30 H new ATOM 751 N LYS A 839 14.640 -22.293 10.343 1.00 53.43 N ATOM 752 CA LYS A 839 15.654 -22.536 11.354 1.00 21.21 C ATOM 753 C LYS A 839 16.208 -21.198 11.847 1.00 65.11 C ATOM 754 O LYS A 839 16.728 -21.109 12.958 1.00 10.23 O ATOM 755 CB LYS A 839 16.727 -23.487 10.819 1.00 40.32 C ATOM 756 CG LYS A 839 16.208 -24.925 10.765 1.00 20.02 C ATOM 757 CD LYS A 839 17.359 -25.927 10.869 1.00 21.54 C ATOM 758 CE LYS A 839 18.586 -25.436 10.098 1.00 33.02 C ATOM 759 NZ LYS A 839 19.606 -24.906 11.030 1.00 12.22 N ATOM 0 H LYS A 839 14.858 -22.671 9.421 1.00 53.43 H new ATOM 0 HA LYS A 839 15.218 -23.038 12.218 1.00 21.21 H new ATOM 0 HB2 LYS A 839 17.035 -23.170 9.823 1.00 40.32 H new ATOM 0 HB3 LYS A 839 17.610 -23.439 11.456 1.00 40.32 H new ATOM 0 HG2 LYS A 839 15.502 -25.091 11.578 1.00 20.02 H new ATOM 0 HG3 LYS A 839 15.665 -25.085 9.834 1.00 20.02 H new ATOM 0 HD2 LYS A 839 17.620 -26.079 11.916 1.00 21.54 H new ATOM 0 HD3 LYS A 839 17.041 -26.893 10.477 1.00 21.54 H new ATOM 0 HE2 LYS A 839 19.008 -26.255 9.515 1.00 33.02 H new ATOM 0 HE3 LYS A 839 18.292 -24.660 9.391 1.00 33.02 H new ATOM 0 HZ1 LYS A 839 19.940 -23.982 10.690 1.00 12.22 H new ATOM 0 HZ2 LYS A 839 19.188 -24.796 11.976 1.00 12.22 H new ATOM 0 HZ3 LYS A 839 20.407 -25.567 11.080 1.00 12.22 H new ATOM 772 N GLU A 840 16.079 -20.191 10.996 1.00 50.10 N ATOM 773 CA GLU A 840 16.561 -18.861 11.331 1.00 75.50 C ATOM 774 C GLU A 840 15.399 -17.975 11.784 1.00 11.31 C ATOM 775 O GLU A 840 15.612 -16.856 12.250 1.00 60.33 O ATOM 776 CB GLU A 840 17.302 -18.233 10.149 1.00 15.23 C ATOM 777 CG GLU A 840 16.415 -18.197 8.903 1.00 42.33 C ATOM 778 CD GLU A 840 16.765 -17.000 8.016 1.00 60.13 C ATOM 779 OE1 GLU A 840 15.960 -16.066 7.889 1.00 15.10 O ATOM 780 OE2 GLU A 840 17.921 -17.062 7.447 1.00 23.43 O ATOM 0 H GLU A 840 15.648 -20.269 10.075 1.00 50.10 H new ATOM 0 HA GLU A 840 17.269 -18.948 12.155 1.00 75.50 H new ATOM 0 HB2 GLU A 840 17.614 -17.221 10.407 1.00 15.23 H new ATOM 0 HB3 GLU A 840 18.208 -18.802 9.939 1.00 15.23 H new ATOM 0 HG2 GLU A 840 16.537 -19.121 8.338 1.00 42.33 H new ATOM 0 HG3 GLU A 840 15.368 -18.141 9.199 1.00 42.33 H new ATOM 788 N CYS A 841 14.195 -18.507 11.632 1.00 24.40 N ATOM 789 CA CYS A 841 13.000 -17.778 12.020 1.00 72.32 C ATOM 790 C CYS A 841 12.700 -18.093 13.487 1.00 50.23 C ATOM 791 O CYS A 841 11.994 -17.339 14.155 1.00 22.21 O ATOM 792 CB CYS A 841 11.815 -18.111 11.111 1.00 53.10 C ATOM 793 SG CYS A 841 12.125 -17.479 9.422 1.00 51.02 S ATOM 0 H CYS A 841 14.022 -19.435 11.245 1.00 24.40 H new ATOM 0 HA CYS A 841 13.171 -16.707 11.907 1.00 72.32 H new ATOM 0 HB2 CYS A 841 11.660 -19.190 11.082 1.00 53.10 H new ATOM 0 HB3 CYS A 841 10.903 -17.669 11.512 1.00 53.10 H new ATOM 0 HG CYS A 841 12.895 -18.308 8.783 1.00 51.02 H new ATOM 799 N PHE A 842 13.251 -19.207 13.944 1.00 23.35 N ATOM 800 CA PHE A 842 13.052 -19.631 15.320 1.00 13.30 C ATOM 801 C PHE A 842 14.361 -19.568 16.108 1.00 24.45 C ATOM 802 O PHE A 842 15.357 -19.033 15.624 1.00 40.22 O ATOM 803 CB PHE A 842 12.565 -21.081 15.276 1.00 45.35 C ATOM 804 CG PHE A 842 13.684 -22.116 15.407 1.00 61.45 C ATOM 805 CD1 PHE A 842 14.609 -22.247 14.418 1.00 73.41 C ATOM 806 CD2 PHE A 842 13.754 -22.906 16.512 1.00 52.12 C ATOM 807 CE1 PHE A 842 15.647 -23.208 14.540 1.00 70.55 C ATOM 808 CE2 PHE A 842 14.792 -23.867 16.633 1.00 10.14 C ATOM 809 CZ PHE A 842 15.717 -23.998 15.645 1.00 53.02 C ATOM 0 H PHE A 842 13.835 -19.830 13.386 1.00 23.35 H new ATOM 0 HA PHE A 842 12.333 -18.975 15.811 1.00 13.30 H new ATOM 0 HB2 PHE A 842 11.844 -21.236 16.079 1.00 45.35 H new ATOM 0 HB3 PHE A 842 12.037 -21.248 14.337 1.00 45.35 H new ATOM 0 HD1 PHE A 842 14.554 -21.620 13.540 1.00 73.41 H new ATOM 0 HD2 PHE A 842 13.020 -22.802 17.297 1.00 52.12 H new ATOM 0 HE1 PHE A 842 16.381 -23.312 13.755 1.00 70.55 H new ATOM 0 HE2 PHE A 842 14.847 -24.494 17.510 1.00 10.14 H new ATOM 0 HZ PHE A 842 16.507 -24.729 15.738 1.00 53.02 H new ATOM 819 N VAL A 843 14.318 -20.124 17.311 1.00 42.43 N ATOM 820 CA VAL A 843 15.489 -20.138 18.171 1.00 42.10 C ATOM 821 C VAL A 843 15.463 -21.397 19.040 1.00 15.54 C ATOM 822 O VAL A 843 14.480 -22.137 19.037 1.00 64.10 O ATOM 823 CB VAL A 843 15.553 -18.847 18.990 1.00 52.13 C ATOM 824 CG1 VAL A 843 15.420 -17.618 18.088 1.00 72.55 C ATOM 825 CG2 VAL A 843 14.486 -18.840 20.086 1.00 31.13 C ATOM 0 H VAL A 843 13.491 -20.568 17.710 1.00 42.43 H new ATOM 0 HA VAL A 843 16.401 -20.174 17.574 1.00 42.10 H new ATOM 0 HB VAL A 843 16.530 -18.804 19.472 1.00 52.13 H new ATOM 0 HG11 VAL A 843 15.469 -16.714 18.695 1.00 72.55 H new ATOM 0 HG12 VAL A 843 16.232 -17.611 17.361 1.00 72.55 H new ATOM 0 HG13 VAL A 843 14.464 -17.652 17.565 1.00 72.55 H new ATOM 0 HG21 VAL A 843 14.553 -17.912 20.653 1.00 31.13 H new ATOM 0 HG22 VAL A 843 13.498 -18.917 19.632 1.00 31.13 H new ATOM 0 HG23 VAL A 843 14.646 -19.686 20.754 1.00 31.13 H new ATOM 835 N SER A 844 16.553 -21.600 19.765 1.00 62.04 N ATOM 836 CA SER A 844 16.667 -22.756 20.637 1.00 23.32 C ATOM 837 C SER A 844 17.284 -22.343 21.975 1.00 63.40 C ATOM 838 O SER A 844 18.232 -21.560 22.010 1.00 14.52 O ATOM 839 CB SER A 844 17.504 -23.858 19.984 1.00 31.44 C ATOM 840 OG SER A 844 18.883 -23.508 19.910 1.00 23.31 O ATOM 0 H SER A 844 17.365 -20.983 19.766 1.00 62.04 H new ATOM 0 HA SER A 844 15.667 -23.152 20.812 1.00 23.32 H new ATOM 0 HB2 SER A 844 17.394 -24.781 20.553 1.00 31.44 H new ATOM 0 HB3 SER A 844 17.126 -24.054 18.981 1.00 31.44 H new ATOM 0 HG SER A 844 19.384 -24.238 19.489 1.00 23.31 H new ATOM 846 N ARG A 845 16.722 -22.889 23.043 1.00 30.51 N ATOM 847 CA ARG A 845 17.205 -22.588 24.380 1.00 50.21 C ATOM 848 C ARG A 845 17.570 -23.878 25.116 1.00 34.35 C ATOM 849 O ARG A 845 17.131 -24.961 24.732 1.00 23.54 O ATOM 850 CB ARG A 845 16.151 -21.828 25.188 1.00 50.01 C ATOM 851 CG ARG A 845 15.269 -20.976 24.274 1.00 54.35 C ATOM 852 CD ARG A 845 16.068 -19.828 23.654 1.00 44.01 C ATOM 853 NE ARG A 845 16.202 -18.721 24.627 1.00 53.11 N ATOM 854 CZ ARG A 845 15.288 -17.740 24.787 1.00 20.13 C ATOM 855 NH1 ARG A 845 14.165 -17.721 24.039 1.00 52.03 N ATOM 856 NH2 ARG A 845 15.509 -16.800 25.687 1.00 5.01 N ATOM 0 H ARG A 845 15.936 -23.539 23.010 1.00 30.51 H new ATOM 0 HA ARG A 845 18.091 -21.961 24.279 1.00 50.21 H new ATOM 0 HB2 ARG A 845 15.532 -22.535 25.741 1.00 50.01 H new ATOM 0 HB3 ARG A 845 16.641 -21.190 25.924 1.00 50.01 H new ATOM 0 HG2 ARG A 845 14.849 -21.599 23.484 1.00 54.35 H new ATOM 0 HG3 ARG A 845 14.431 -20.574 24.843 1.00 54.35 H new ATOM 0 HD2 ARG A 845 17.055 -20.181 23.354 1.00 44.01 H new ATOM 0 HD3 ARG A 845 15.569 -19.472 22.752 1.00 44.01 H new ATOM 0 HE ARG A 845 17.036 -18.698 25.213 1.00 53.11 H new ATOM 0 HH11 ARG A 845 14.001 -18.451 23.346 1.00 52.03 H new ATOM 0 HH12 ARG A 845 13.480 -16.976 24.166 1.00 52.03 H new ATOM 0 HH21 ARG A 845 16.360 -16.822 26.249 1.00 5.01 H new ATOM 0 HH22 ARG A 845 14.829 -16.052 25.821 1.00 5.01 H new ATOM 869 N PRO A 846 18.389 -23.716 26.189 1.00 4.24 N ATOM 870 CA PRO A 846 18.818 -24.855 26.983 1.00 10.11 C ATOM 871 C PRO A 846 17.685 -25.355 27.881 1.00 34.01 C ATOM 872 O PRO A 846 16.920 -26.236 27.490 1.00 42.44 O ATOM 873 CB PRO A 846 20.022 -24.358 27.767 1.00 54.31 C ATOM 874 CG PRO A 846 19.940 -22.840 27.738 1.00 62.14 C ATOM 875 CD PRO A 846 18.928 -22.448 26.674 1.00 61.15 C ATOM 0 HA PRO A 846 19.086 -25.717 26.371 1.00 10.11 H new ATOM 0 HB2 PRO A 846 20.002 -24.731 28.791 1.00 54.31 H new ATOM 0 HB3 PRO A 846 20.952 -24.708 27.318 1.00 54.31 H new ATOM 0 HG2 PRO A 846 19.638 -22.455 28.712 1.00 62.14 H new ATOM 0 HG3 PRO A 846 20.916 -22.409 27.514 1.00 62.14 H new ATOM 0 HD2 PRO A 846 18.142 -21.817 27.089 1.00 61.15 H new ATOM 0 HD3 PRO A 846 19.399 -21.884 25.869 1.00 61.15 H new ATOM 1029 N PHE A 856 6.423 -36.470 23.672 1.00 1.13 N ATOM 1030 CA PHE A 856 7.808 -36.898 23.575 1.00 4.33 C ATOM 1031 C PHE A 856 8.661 -36.248 24.667 1.00 13.41 C ATOM 1032 O PHE A 856 8.141 -35.530 25.521 1.00 61.25 O ATOM 1033 CB PHE A 856 8.321 -36.445 22.207 1.00 45.20 C ATOM 1034 CG PHE A 856 8.075 -37.455 21.084 1.00 14.34 C ATOM 1035 CD1 PHE A 856 8.323 -38.776 21.291 1.00 4.33 C ATOM 1036 CD2 PHE A 856 7.606 -37.031 19.880 1.00 63.42 C ATOM 1037 CE1 PHE A 856 8.094 -39.713 20.249 1.00 3.15 C ATOM 1038 CE2 PHE A 856 7.377 -37.969 18.838 1.00 43.31 C ATOM 1039 CZ PHE A 856 7.626 -39.290 19.045 1.00 42.33 C ATOM 0 HA PHE A 856 7.873 -37.979 23.696 1.00 4.33 H new ATOM 0 HB2 PHE A 856 7.842 -35.502 21.945 1.00 45.20 H new ATOM 0 HB3 PHE A 856 9.391 -36.250 22.278 1.00 45.20 H new ATOM 0 HD1 PHE A 856 8.694 -39.112 22.248 1.00 4.33 H new ATOM 0 HD2 PHE A 856 7.408 -35.982 19.716 1.00 63.42 H new ATOM 0 HE1 PHE A 856 8.292 -40.762 20.413 1.00 3.15 H new ATOM 0 HE2 PHE A 856 7.005 -37.633 17.881 1.00 43.31 H new ATOM 0 HZ PHE A 856 7.452 -40.003 18.253 1.00 42.33 H new ATOM 1049 N GLU A 857 9.955 -36.522 24.604 1.00 24.15 N ATOM 1050 CA GLU A 857 10.885 -35.973 25.577 1.00 33.02 C ATOM 1051 C GLU A 857 11.429 -34.628 25.091 1.00 32.21 C ATOM 1052 O GLU A 857 12.175 -34.573 24.115 1.00 41.21 O ATOM 1053 CB GLU A 857 12.023 -36.954 25.862 1.00 23.33 C ATOM 1054 CG GLU A 857 11.494 -38.383 26.001 1.00 70.23 C ATOM 1055 CD GLU A 857 12.576 -39.318 26.545 1.00 33.30 C ATOM 1056 OE1 GLU A 857 13.187 -39.021 27.582 1.00 24.40 O ATOM 1057 OE2 GLU A 857 12.772 -40.388 25.851 1.00 53.22 O ATOM 0 H GLU A 857 10.382 -37.117 23.894 1.00 24.15 H new ATOM 0 HA GLU A 857 10.348 -35.809 26.511 1.00 33.02 H new ATOM 0 HB2 GLU A 857 12.756 -36.911 25.056 1.00 23.33 H new ATOM 0 HB3 GLU A 857 12.538 -36.663 26.777 1.00 23.33 H new ATOM 0 HG2 GLU A 857 10.632 -38.392 26.668 1.00 70.23 H new ATOM 0 HG3 GLU A 857 11.151 -38.743 25.031 1.00 70.23 H new ATOM 1065 N LYS A 858 11.034 -33.577 25.794 1.00 30.14 N ATOM 1066 CA LYS A 858 11.473 -32.236 25.447 1.00 72.22 C ATOM 1067 C LYS A 858 12.476 -31.745 26.492 1.00 22.54 C ATOM 1068 O LYS A 858 12.153 -31.662 27.676 1.00 4.14 O ATOM 1069 CB LYS A 858 10.269 -31.309 25.266 1.00 5.32 C ATOM 1070 CG LYS A 858 9.123 -31.711 26.196 1.00 10.43 C ATOM 1071 CD LYS A 858 8.076 -30.599 26.288 1.00 54.04 C ATOM 1072 CE LYS A 858 8.391 -29.641 27.438 1.00 25.22 C ATOM 1073 NZ LYS A 858 9.815 -29.237 27.400 1.00 32.34 N ATOM 0 H LYS A 858 10.414 -33.627 26.603 1.00 30.14 H new ATOM 0 HA LYS A 858 11.990 -32.241 24.487 1.00 72.22 H new ATOM 0 HB2 LYS A 858 10.564 -30.280 25.470 1.00 5.32 H new ATOM 0 HB3 LYS A 858 9.931 -31.344 24.230 1.00 5.32 H new ATOM 0 HG2 LYS A 858 8.656 -32.625 25.830 1.00 10.43 H new ATOM 0 HG3 LYS A 858 9.515 -31.929 27.189 1.00 10.43 H new ATOM 0 HD2 LYS A 858 8.044 -30.047 25.349 1.00 54.04 H new ATOM 0 HD3 LYS A 858 7.088 -31.036 26.435 1.00 54.04 H new ATOM 0 HE2 LYS A 858 7.754 -28.759 27.369 1.00 25.22 H new ATOM 0 HE3 LYS A 858 8.168 -30.121 28.391 1.00 25.22 H new ATOM 0 HZ1 LYS A 858 10.021 -28.614 28.207 1.00 32.34 H new ATOM 0 HZ2 LYS A 858 10.417 -30.083 27.454 1.00 32.34 H new ATOM 0 HZ3 LYS A 858 10.008 -28.730 26.513 1.00 32.34 H new ATOM 1086 N ARG A 859 13.673 -31.434 26.017 1.00 51.31 N ATOM 1087 CA ARG A 859 14.726 -30.953 26.896 1.00 75.51 C ATOM 1088 C ARG A 859 15.178 -29.556 26.468 1.00 11.11 C ATOM 1089 O ARG A 859 15.996 -28.931 27.141 1.00 30.25 O ATOM 1090 CB ARG A 859 15.929 -31.898 26.881 1.00 31.24 C ATOM 1091 CG ARG A 859 16.097 -32.551 25.508 1.00 50.22 C ATOM 1092 CD ARG A 859 16.473 -31.512 24.449 1.00 12.23 C ATOM 1093 NE ARG A 859 17.260 -32.150 23.371 1.00 71.03 N ATOM 1094 CZ ARG A 859 18.579 -32.423 23.457 1.00 61.44 C ATOM 1095 NH1 ARG A 859 19.271 -32.116 24.574 1.00 2.22 N ATOM 1096 NH2 ARG A 859 19.182 -32.996 22.431 1.00 2.24 N ATOM 0 H ARG A 859 13.937 -31.506 25.034 1.00 51.31 H new ATOM 0 HA ARG A 859 14.322 -30.913 27.907 1.00 75.51 H new ATOM 0 HB2 ARG A 859 16.833 -31.346 27.138 1.00 31.24 H new ATOM 0 HB3 ARG A 859 15.800 -32.669 27.641 1.00 31.24 H new ATOM 0 HG2 ARG A 859 16.868 -33.319 25.559 1.00 50.22 H new ATOM 0 HG3 ARG A 859 15.170 -33.048 25.222 1.00 50.22 H new ATOM 0 HD2 ARG A 859 15.572 -31.061 24.034 1.00 12.23 H new ATOM 0 HD3 ARG A 859 17.051 -30.708 24.905 1.00 12.23 H new ATOM 0 HE ARG A 859 16.775 -32.399 22.509 1.00 71.03 H new ATOM 0 HH11 ARG A 859 18.797 -31.674 25.362 1.00 2.22 H new ATOM 0 HH12 ARG A 859 20.268 -32.326 24.630 1.00 2.22 H new ATOM 0 HH21 ARG A 859 18.651 -33.225 21.591 1.00 2.24 H new ATOM 0 HH22 ARG A 859 20.178 -33.209 22.479 1.00 2.24 H new ATOM 1109 N ALA A 860 14.626 -29.106 25.351 1.00 74.10 N ATOM 1110 CA ALA A 860 14.962 -27.794 24.825 1.00 0.25 C ATOM 1111 C ALA A 860 13.699 -27.133 24.268 1.00 25.32 C ATOM 1112 O ALA A 860 13.106 -27.629 23.312 1.00 73.12 O ATOM 1113 CB ALA A 860 16.062 -27.933 23.771 1.00 55.34 C ATOM 0 H ALA A 860 13.948 -29.627 24.795 1.00 74.10 H new ATOM 0 HA ALA A 860 15.348 -27.151 25.616 1.00 0.25 H new ATOM 0 HB1 ALA A 860 16.314 -26.949 23.376 1.00 55.34 H new ATOM 0 HB2 ALA A 860 16.947 -28.379 24.225 1.00 55.34 H new ATOM 0 HB3 ALA A 860 15.710 -28.570 22.960 1.00 55.34 H new ATOM 1119 N LYS A 861 13.326 -26.025 24.890 1.00 4.43 N ATOM 1120 CA LYS A 861 12.145 -25.291 24.468 1.00 21.14 C ATOM 1121 C LYS A 861 12.535 -24.286 23.383 1.00 0.41 C ATOM 1122 O LYS A 861 13.403 -23.441 23.598 1.00 51.34 O ATOM 1123 CB LYS A 861 11.450 -24.656 25.674 1.00 0.23 C ATOM 1124 CG LYS A 861 10.849 -25.726 26.587 1.00 35.22 C ATOM 1125 CD LYS A 861 11.946 -26.509 27.312 1.00 52.34 C ATOM 1126 CE LYS A 861 11.452 -27.018 28.667 1.00 20.11 C ATOM 1127 NZ LYS A 861 12.147 -28.273 29.034 1.00 53.53 N ATOM 0 H LYS A 861 13.821 -25.617 25.683 1.00 4.43 H new ATOM 0 HA LYS A 861 11.413 -25.968 24.027 1.00 21.14 H new ATOM 0 HB2 LYS A 861 12.165 -24.054 26.235 1.00 0.23 H new ATOM 0 HB3 LYS A 861 10.665 -23.982 25.332 1.00 0.23 H new ATOM 0 HG2 LYS A 861 10.189 -25.257 27.317 1.00 35.22 H new ATOM 0 HG3 LYS A 861 10.238 -26.410 25.998 1.00 35.22 H new ATOM 0 HD2 LYS A 861 12.264 -27.351 26.697 1.00 52.34 H new ATOM 0 HD3 LYS A 861 12.819 -25.872 27.455 1.00 52.34 H new ATOM 0 HE2 LYS A 861 11.627 -26.261 29.432 1.00 20.11 H new ATOM 0 HE3 LYS A 861 10.376 -27.189 28.628 1.00 20.11 H new ATOM 0 HZ1 LYS A 861 11.618 -28.755 29.788 1.00 53.53 H new ATOM 0 HZ2 LYS A 861 12.206 -28.893 28.201 1.00 53.53 H new ATOM 0 HZ3 LYS A 861 13.106 -28.053 29.370 1.00 53.53 H new ATOM 1140 N ILE A 862 11.875 -24.410 22.241 1.00 33.13 N ATOM 1141 CA ILE A 862 12.141 -23.523 21.122 1.00 44.30 C ATOM 1142 C ILE A 862 11.256 -22.280 21.240 1.00 64.23 C ATOM 1143 O ILE A 862 10.327 -22.250 22.045 1.00 51.22 O ATOM 1144 CB ILE A 862 11.980 -24.269 19.796 1.00 21.22 C ATOM 1145 CG1 ILE A 862 10.507 -24.571 19.512 1.00 1.44 C ATOM 1146 CG2 ILE A 862 12.839 -25.535 19.772 1.00 42.03 C ATOM 1147 CD1 ILE A 862 10.159 -24.275 18.052 1.00 34.41 C ATOM 0 H ILE A 862 11.156 -25.112 22.067 1.00 33.13 H new ATOM 0 HA ILE A 862 13.176 -23.181 21.145 1.00 44.30 H new ATOM 0 HB ILE A 862 12.336 -23.622 18.994 1.00 21.22 H new ATOM 0 HG12 ILE A 862 10.297 -25.617 19.735 1.00 1.44 H new ATOM 0 HG13 ILE A 862 9.876 -23.972 20.169 1.00 1.44 H new ATOM 0 HG21 ILE A 862 12.706 -26.047 18.819 1.00 42.03 H new ATOM 0 HG22 ILE A 862 13.888 -25.265 19.896 1.00 42.03 H new ATOM 0 HG23 ILE A 862 12.536 -26.196 20.584 1.00 42.03 H new ATOM 0 HD11 ILE A 862 9.107 -24.498 17.876 1.00 34.41 H new ATOM 0 HD12 ILE A 862 10.347 -23.223 17.839 1.00 34.41 H new ATOM 0 HD13 ILE A 862 10.775 -24.893 17.399 1.00 34.41 H new ATOM 1159 N PHE A 863 11.577 -21.286 20.425 1.00 14.52 N ATOM 1160 CA PHE A 863 10.822 -20.044 20.428 1.00 42.41 C ATOM 1161 C PHE A 863 11.012 -19.284 19.113 1.00 11.04 C ATOM 1162 O PHE A 863 11.777 -19.711 18.250 1.00 34.50 O ATOM 1163 CB PHE A 863 11.365 -19.193 21.578 1.00 44.03 C ATOM 1164 CG PHE A 863 11.236 -19.850 22.953 1.00 33.33 C ATOM 1165 CD1 PHE A 863 12.235 -20.643 23.425 1.00 10.11 C ATOM 1166 CD2 PHE A 863 10.121 -19.642 23.704 1.00 10.12 C ATOM 1167 CE1 PHE A 863 12.115 -21.253 24.702 1.00 54.12 C ATOM 1168 CE2 PHE A 863 10.001 -20.252 24.981 1.00 54.23 C ATOM 1169 CZ PHE A 863 11.000 -21.044 25.453 1.00 71.53 C ATOM 0 H PHE A 863 12.349 -21.315 19.759 1.00 14.52 H new ATOM 0 HA PHE A 863 9.759 -20.255 20.545 1.00 42.41 H new ATOM 0 HB2 PHE A 863 12.416 -18.973 21.389 1.00 44.03 H new ATOM 0 HB3 PHE A 863 10.837 -18.239 21.591 1.00 44.03 H new ATOM 0 HD1 PHE A 863 13.120 -20.809 22.829 1.00 10.11 H new ATOM 0 HD2 PHE A 863 9.327 -19.013 23.329 1.00 10.12 H new ATOM 0 HE1 PHE A 863 12.909 -21.882 25.077 1.00 54.12 H new ATOM 0 HE2 PHE A 863 9.116 -20.087 25.577 1.00 54.23 H new ATOM 0 HZ PHE A 863 10.909 -21.507 26.424 1.00 71.53 H new ATOM 1179 N CYS A 864 10.303 -18.170 19.003 1.00 74.42 N ATOM 1180 CA CYS A 864 10.383 -17.347 17.808 1.00 22.22 C ATOM 1181 C CYS A 864 11.643 -16.485 17.903 1.00 2.43 C ATOM 1182 O CYS A 864 12.002 -16.020 18.985 1.00 73.45 O ATOM 1183 CB CYS A 864 9.124 -16.499 17.620 1.00 72.14 C ATOM 1184 SG CYS A 864 9.013 -15.920 15.887 1.00 10.13 S ATOM 0 H CYS A 864 9.671 -17.818 19.722 1.00 74.42 H new ATOM 0 HA CYS A 864 10.446 -17.985 16.927 1.00 22.22 H new ATOM 0 HB2 CYS A 864 8.240 -17.084 17.874 1.00 72.14 H new ATOM 0 HB3 CYS A 864 9.146 -15.645 18.297 1.00 72.14 H new ATOM 0 HG CYS A 864 8.367 -16.797 15.177 1.00 10.13 H new ATOM 1190 N ALA A 865 12.281 -16.296 16.757 1.00 15.02 N ATOM 1191 CA ALA A 865 13.493 -15.497 16.698 1.00 71.32 C ATOM 1192 C ALA A 865 13.120 -14.014 16.653 1.00 73.22 C ATOM 1193 O ALA A 865 13.964 -13.151 16.887 1.00 52.42 O ATOM 1194 CB ALA A 865 14.328 -15.925 15.489 1.00 33.41 C ATOM 0 H ALA A 865 11.981 -16.683 15.862 1.00 15.02 H new ATOM 0 HA ALA A 865 14.102 -15.657 17.588 1.00 71.32 H new ATOM 0 HB1 ALA A 865 15.237 -15.326 15.444 1.00 33.41 H new ATOM 0 HB2 ALA A 865 14.592 -16.978 15.584 1.00 33.41 H new ATOM 0 HB3 ALA A 865 13.750 -15.776 14.577 1.00 33.41 H new ATOM 1200 N ARG A 866 11.854 -13.764 16.350 1.00 23.23 N ATOM 1201 CA ARG A 866 11.359 -12.400 16.272 1.00 70.44 C ATOM 1202 C ARG A 866 11.542 -11.691 17.615 1.00 40.13 C ATOM 1203 O ARG A 866 11.820 -12.332 18.627 1.00 63.22 O ATOM 1204 CB ARG A 866 9.879 -12.374 15.886 1.00 14.40 C ATOM 1205 CG ARG A 866 9.654 -13.039 14.527 1.00 71.22 C ATOM 1206 CD ARG A 866 9.860 -12.040 13.386 1.00 23.43 C ATOM 1207 NE ARG A 866 11.290 -11.994 13.007 1.00 41.11 N ATOM 1208 CZ ARG A 866 11.842 -11.020 12.252 1.00 14.23 C ATOM 1209 NH1 ARG A 866 11.086 -10.001 11.789 1.00 22.23 N ATOM 1210 NH2 ARG A 866 13.131 -11.078 11.974 1.00 74.21 N ATOM 0 H ARG A 866 11.157 -14.483 16.156 1.00 23.23 H new ATOM 0 HA ARG A 866 11.933 -11.882 15.504 1.00 70.44 H new ATOM 0 HB2 ARG A 866 9.292 -12.888 16.648 1.00 14.40 H new ATOM 0 HB3 ARG A 866 9.526 -11.343 15.853 1.00 14.40 H new ATOM 0 HG2 ARG A 866 10.341 -13.877 14.410 1.00 71.22 H new ATOM 0 HG3 ARG A 866 8.644 -13.446 14.480 1.00 71.22 H new ATOM 0 HD2 ARG A 866 9.256 -12.328 12.526 1.00 23.43 H new ATOM 0 HD3 ARG A 866 9.525 -11.050 13.694 1.00 23.43 H new ATOM 0 HE ARG A 866 11.896 -12.745 13.337 1.00 41.11 H new ATOM 0 HH11 ARG A 866 10.091 -9.963 12.009 1.00 22.23 H new ATOM 0 HH12 ARG A 866 11.510 -9.269 11.219 1.00 22.23 H new ATOM 0 HH21 ARG A 866 13.695 -11.851 12.328 1.00 74.21 H new ATOM 0 HH22 ARG A 866 13.563 -10.350 11.405 1.00 74.21 H new ATOM 1223 N GLN A 867 11.378 -10.377 17.581 1.00 44.44 N ATOM 1224 CA GLN A 867 11.522 -9.573 18.783 1.00 41.03 C ATOM 1225 C GLN A 867 10.867 -10.276 19.973 1.00 73.41 C ATOM 1226 O GLN A 867 11.294 -10.103 21.113 1.00 22.21 O ATOM 1227 CB GLN A 867 10.935 -8.175 18.581 1.00 50.31 C ATOM 1228 CG GLN A 867 11.839 -7.324 17.686 1.00 72.30 C ATOM 1229 CD GLN A 867 11.369 -5.868 17.658 1.00 61.54 C ATOM 1230 OE1 GLN A 867 10.498 -5.456 18.405 1.00 12.42 O ATOM 1231 NE2 GLN A 867 11.993 -5.116 16.756 1.00 63.12 N ATOM 0 H GLN A 867 11.147 -9.849 16.740 1.00 44.44 H new ATOM 0 HA GLN A 867 12.585 -9.458 18.994 1.00 41.03 H new ATOM 0 HB2 GLN A 867 9.944 -8.254 18.133 1.00 50.31 H new ATOM 0 HB3 GLN A 867 10.810 -7.686 19.547 1.00 50.31 H new ATOM 0 HG2 GLN A 867 12.865 -7.372 18.050 1.00 72.30 H new ATOM 0 HG3 GLN A 867 11.840 -7.729 16.674 1.00 72.30 H new ATOM 0 HE21 GLN A 867 12.714 -5.525 16.162 1.00 63.12 H new ATOM 0 HE22 GLN A 867 11.751 -4.130 16.659 1.00 63.12 H new ATOM 1240 N ASN A 868 9.839 -11.055 19.667 1.00 64.12 N ATOM 1241 CA ASN A 868 9.121 -11.785 20.697 1.00 33.31 C ATOM 1242 C ASN A 868 10.111 -12.627 21.504 1.00 30.32 C ATOM 1243 O ASN A 868 10.869 -13.413 20.938 1.00 43.22 O ATOM 1244 CB ASN A 868 8.087 -12.731 20.083 1.00 61.15 C ATOM 1245 CG ASN A 868 7.322 -12.045 18.949 1.00 61.42 C ATOM 1246 OD1 ASN A 868 7.480 -12.358 17.780 1.00 21.42 O ATOM 1247 ND2 ASN A 868 6.486 -11.095 19.358 1.00 45.14 N ATOM 0 H ASN A 868 9.487 -11.196 18.720 1.00 64.12 H new ATOM 0 HA ASN A 868 8.613 -11.059 21.332 1.00 33.31 H new ATOM 0 HB2 ASN A 868 8.585 -13.623 19.703 1.00 61.15 H new ATOM 0 HB3 ASN A 868 7.388 -13.060 20.852 1.00 61.15 H new ATOM 0 HD21 ASN A 868 5.929 -10.578 18.678 1.00 45.14 H new ATOM 0 HD22 ASN A 868 6.402 -10.883 20.352 1.00 45.14 H new ATOM 1254 N CYS A 869 10.072 -12.435 22.814 1.00 10.45 N ATOM 1255 CA CYS A 869 10.956 -13.166 23.705 1.00 25.42 C ATOM 1256 C CYS A 869 10.137 -14.246 24.415 1.00 24.11 C ATOM 1257 O CYS A 869 10.577 -15.389 24.529 1.00 72.43 O ATOM 1258 CB CYS A 869 11.656 -12.236 24.698 1.00 41.21 C ATOM 1259 SG CYS A 869 10.424 -11.173 25.534 1.00 14.42 S ATOM 0 H CYS A 869 9.441 -11.783 23.280 1.00 10.45 H new ATOM 0 HA CYS A 869 11.751 -13.636 23.126 1.00 25.42 H new ATOM 0 HB2 CYS A 869 12.202 -12.823 25.436 1.00 41.21 H new ATOM 0 HB3 CYS A 869 12.388 -11.618 24.177 1.00 41.21 H new ATOM 0 HG CYS A 869 9.645 -11.908 26.270 1.00 14.42 H new ATOM 1265 N SER A 870 8.961 -13.845 24.874 1.00 21.24 N ATOM 1266 CA SER A 870 8.077 -14.764 25.570 1.00 35.42 C ATOM 1267 C SER A 870 7.131 -15.437 24.573 1.00 41.13 C ATOM 1268 O SER A 870 5.977 -15.714 24.895 1.00 11.45 O ATOM 1269 CB SER A 870 7.276 -14.043 26.656 1.00 2.22 C ATOM 1270 OG SER A 870 8.016 -12.977 27.245 1.00 24.05 O ATOM 0 H SER A 870 8.600 -12.896 24.778 1.00 21.24 H new ATOM 0 HA SER A 870 8.689 -15.526 26.053 1.00 35.42 H new ATOM 0 HB2 SER A 870 6.354 -13.651 26.227 1.00 2.22 H new ATOM 0 HB3 SER A 870 6.989 -14.756 27.429 1.00 2.22 H new ATOM 0 HG SER A 870 7.470 -12.540 27.932 1.00 24.05 H new ATOM 1276 N HIS A 871 7.656 -15.680 23.381 1.00 71.43 N ATOM 1277 CA HIS A 871 6.873 -16.315 22.334 1.00 63.21 C ATOM 1278 C HIS A 871 7.478 -17.680 21.997 1.00 13.23 C ATOM 1279 O HIS A 871 8.535 -17.758 21.373 1.00 13.20 O ATOM 1280 CB HIS A 871 6.756 -15.401 21.113 1.00 44.12 C ATOM 1281 CG HIS A 871 6.159 -16.071 19.899 1.00 73.23 C ATOM 1282 ND1 HIS A 871 6.017 -15.429 18.681 1.00 4.31 N ATOM 1283 CD2 HIS A 871 5.669 -17.333 19.728 1.00 50.43 C ATOM 1284 CE1 HIS A 871 5.466 -16.274 17.824 1.00 75.45 C ATOM 1285 NE2 HIS A 871 5.250 -17.454 18.474 1.00 12.32 N ATOM 0 H HIS A 871 8.614 -15.449 23.117 1.00 71.43 H new ATOM 0 HA HIS A 871 5.856 -16.484 22.687 1.00 63.21 H new ATOM 0 HB2 HIS A 871 6.145 -14.537 21.376 1.00 44.12 H new ATOM 0 HB3 HIS A 871 7.747 -15.025 20.857 1.00 44.12 H new ATOM 0 HD2 HIS A 871 5.629 -18.103 20.484 1.00 50.43 H new ATOM 0 HE1 HIS A 871 5.229 -16.066 16.791 1.00 75.45 H new ATOM 0 HE2 HIS A 871 4.835 -18.291 18.064 1.00 12.32 H new ATOM 1293 N ASP A 872 6.781 -18.722 22.426 1.00 54.13 N ATOM 1294 CA ASP A 872 7.235 -20.080 22.178 1.00 42.54 C ATOM 1295 C ASP A 872 6.407 -20.691 21.046 1.00 63.14 C ATOM 1296 O ASP A 872 5.179 -20.641 21.073 1.00 14.42 O ATOM 1297 CB ASP A 872 7.058 -20.955 23.419 1.00 33.35 C ATOM 1298 CG ASP A 872 7.895 -22.236 23.432 1.00 35.24 C ATOM 1299 OD1 ASP A 872 8.423 -22.643 24.478 1.00 72.33 O ATOM 1300 OD2 ASP A 872 7.996 -22.833 22.293 1.00 13.31 O ATOM 0 H ASP A 872 5.905 -18.653 22.944 1.00 54.13 H new ATOM 0 HA ASP A 872 8.292 -20.039 21.914 1.00 42.54 H new ATOM 0 HB2 ASP A 872 7.310 -20.365 24.300 1.00 33.35 H new ATOM 0 HB3 ASP A 872 6.006 -21.225 23.507 1.00 33.35 H new ATOM 1306 N TRP A 873 7.114 -21.255 20.077 1.00 54.33 N ATOM 1307 CA TRP A 873 6.459 -21.875 18.937 1.00 24.34 C ATOM 1308 C TRP A 873 6.024 -23.283 19.351 1.00 51.50 C ATOM 1309 O TRP A 873 4.874 -23.666 19.144 1.00 72.32 O ATOM 1310 CB TRP A 873 7.373 -21.869 17.710 1.00 12.31 C ATOM 1311 CG TRP A 873 7.325 -20.568 16.906 1.00 4.10 C ATOM 1312 CD1 TRP A 873 7.077 -19.330 17.354 1.00 41.40 C ATOM 1313 CD2 TRP A 873 7.543 -20.426 15.486 1.00 23.24 C ATOM 1314 NE1 TRP A 873 7.119 -18.404 16.331 1.00 12.13 N ATOM 1315 CE2 TRP A 873 7.411 -19.092 15.160 1.00 64.05 C ATOM 1316 CE3 TRP A 873 7.842 -21.393 14.511 1.00 62.53 C ATOM 1317 CZ2 TRP A 873 7.561 -18.604 13.856 1.00 3.41 C ATOM 1318 CZ3 TRP A 873 7.989 -20.889 13.213 1.00 71.21 C ATOM 1319 CH2 TRP A 873 7.859 -19.549 12.867 1.00 21.15 C ATOM 0 H TRP A 873 8.133 -21.296 20.058 1.00 54.33 H new ATOM 0 HA TRP A 873 5.575 -21.309 18.644 1.00 24.34 H new ATOM 0 HB2 TRP A 873 8.399 -22.047 18.033 1.00 12.31 H new ATOM 0 HB3 TRP A 873 7.095 -22.697 17.058 1.00 12.31 H new ATOM 0 HD1 TRP A 873 6.870 -19.087 18.386 1.00 41.40 H new ATOM 0 HE1 TRP A 873 6.964 -17.400 16.419 1.00 12.13 H new ATOM 0 HE3 TRP A 873 7.950 -22.442 14.744 1.00 62.53 H new ATOM 0 HZ2 TRP A 873 7.453 -17.554 13.626 1.00 3.41 H new ATOM 0 HZ3 TRP A 873 8.220 -21.591 12.425 1.00 71.21 H new ATOM 0 HH2 TRP A 873 7.987 -19.239 11.841 1.00 21.15 H new ATOM 1330 N GLY A 874 6.966 -24.013 19.928 1.00 23.22 N ATOM 1331 CA GLY A 874 6.694 -25.370 20.373 1.00 45.43 C ATOM 1332 C GLY A 874 7.778 -25.859 21.336 1.00 42.42 C ATOM 1333 O GLY A 874 7.978 -25.274 22.399 1.00 23.03 O ATOM 0 H GLY A 874 7.919 -23.691 20.098 1.00 23.22 H new ATOM 0 HA2 GLY A 874 5.722 -25.407 20.865 1.00 45.43 H new ATOM 0 HA3 GLY A 874 6.641 -26.035 19.511 1.00 45.43 H new ATOM 1337 N ILE A 875 8.449 -26.926 20.928 1.00 21.04 N ATOM 1338 CA ILE A 875 9.507 -27.500 21.742 1.00 63.31 C ATOM 1339 C ILE A 875 10.503 -28.227 20.836 1.00 22.52 C ATOM 1340 O ILE A 875 10.267 -28.373 19.638 1.00 54.31 O ATOM 1341 CB ILE A 875 8.917 -28.385 22.842 1.00 3.31 C ATOM 1342 CG1 ILE A 875 7.613 -29.038 22.380 1.00 11.43 C ATOM 1343 CG2 ILE A 875 8.735 -27.596 24.141 1.00 64.33 C ATOM 1344 CD1 ILE A 875 7.869 -30.032 21.246 1.00 50.32 C ATOM 0 H ILE A 875 8.281 -27.408 20.045 1.00 21.04 H new ATOM 0 HA ILE A 875 10.059 -26.715 22.259 1.00 63.31 H new ATOM 0 HB ILE A 875 9.623 -29.189 23.050 1.00 3.31 H new ATOM 0 HG12 ILE A 875 7.142 -29.551 23.219 1.00 11.43 H new ATOM 0 HG13 ILE A 875 6.916 -28.270 22.045 1.00 11.43 H new ATOM 0 HG21 ILE A 875 8.314 -28.248 24.907 1.00 64.33 H new ATOM 0 HG22 ILE A 875 9.701 -27.219 24.476 1.00 64.33 H new ATOM 0 HG23 ILE A 875 8.060 -26.758 23.966 1.00 64.33 H new ATOM 0 HD11 ILE A 875 6.926 -30.482 20.937 1.00 50.32 H new ATOM 0 HD12 ILE A 875 8.318 -29.511 20.400 1.00 50.32 H new ATOM 0 HD13 ILE A 875 8.547 -30.812 21.592 1.00 50.32 H new ATOM 1356 N HIS A 876 11.596 -28.665 21.444 1.00 62.23 N ATOM 1357 CA HIS A 876 12.629 -29.374 20.707 1.00 1.21 C ATOM 1358 C HIS A 876 12.809 -30.775 21.295 1.00 51.03 C ATOM 1359 O HIS A 876 13.325 -30.927 22.401 1.00 53.30 O ATOM 1360 CB HIS A 876 13.930 -28.569 20.685 1.00 52.41 C ATOM 1361 CG HIS A 876 14.703 -28.686 19.393 1.00 55.43 C ATOM 1362 ND1 HIS A 876 15.180 -27.585 18.702 1.00 35.02 N ATOM 1363 CD2 HIS A 876 15.076 -29.783 18.674 1.00 5.11 C ATOM 1364 CE1 HIS A 876 15.810 -28.012 17.618 1.00 34.40 C ATOM 1365 NE2 HIS A 876 15.744 -29.375 17.602 1.00 2.20 N ATOM 0 H HIS A 876 11.789 -28.543 22.438 1.00 62.23 H new ATOM 0 HA HIS A 876 12.324 -29.490 19.667 1.00 1.21 H new ATOM 0 HB2 HIS A 876 13.699 -27.519 20.864 1.00 52.41 H new ATOM 0 HB3 HIS A 876 14.564 -28.900 21.507 1.00 52.41 H new ATOM 0 HD1 HIS A 876 15.066 -26.610 18.981 1.00 35.02 H new ATOM 0 HD2 HIS A 876 14.864 -30.810 18.933 1.00 5.11 H new ATOM 0 HE1 HIS A 876 16.291 -27.391 16.877 1.00 34.40 H new ATOM 1373 N VAL A 877 12.373 -31.764 20.528 1.00 44.33 N ATOM 1374 CA VAL A 877 12.480 -33.147 20.958 1.00 32.43 C ATOM 1375 C VAL A 877 13.435 -33.895 20.026 1.00 22.01 C ATOM 1376 O VAL A 877 14.074 -33.287 19.168 1.00 33.23 O ATOM 1377 CB VAL A 877 11.090 -33.783 21.025 1.00 74.14 C ATOM 1378 CG1 VAL A 877 10.045 -32.770 21.498 1.00 45.12 C ATOM 1379 CG2 VAL A 877 10.697 -34.385 19.674 1.00 61.01 C ATOM 0 H VAL A 877 11.945 -31.634 19.611 1.00 44.33 H new ATOM 0 HA VAL A 877 12.898 -33.203 21.963 1.00 32.43 H new ATOM 0 HB VAL A 877 11.127 -34.592 21.755 1.00 74.14 H new ATOM 0 HG11 VAL A 877 9.066 -33.248 21.537 1.00 45.12 H new ATOM 0 HG12 VAL A 877 10.312 -32.409 22.491 1.00 45.12 H new ATOM 0 HG13 VAL A 877 10.012 -31.931 20.804 1.00 45.12 H new ATOM 0 HG21 VAL A 877 9.705 -34.831 19.749 1.00 61.01 H new ATOM 0 HG22 VAL A 877 10.687 -33.602 18.916 1.00 61.01 H new ATOM 0 HG23 VAL A 877 11.419 -35.152 19.394 1.00 61.01 H new ATOM 1389 N LYS A 878 13.503 -35.203 20.226 1.00 62.01 N ATOM 1390 CA LYS A 878 14.370 -36.040 19.414 1.00 60.11 C ATOM 1391 C LYS A 878 13.514 -37.003 18.588 1.00 44.31 C ATOM 1392 O LYS A 878 12.550 -37.573 19.095 1.00 14.42 O ATOM 1393 CB LYS A 878 15.412 -36.740 20.289 1.00 42.43 C ATOM 1394 CG LYS A 878 16.007 -37.952 19.569 1.00 5.33 C ATOM 1395 CD LYS A 878 17.475 -38.152 19.955 1.00 74.04 C ATOM 1396 CE LYS A 878 17.870 -39.627 19.860 1.00 34.15 C ATOM 1397 NZ LYS A 878 17.730 -40.113 18.470 1.00 73.34 N ATOM 0 H LYS A 878 12.972 -35.704 20.938 1.00 62.01 H new ATOM 0 HA LYS A 878 14.936 -35.431 18.709 1.00 60.11 H new ATOM 0 HB2 LYS A 878 16.206 -36.039 20.546 1.00 42.43 H new ATOM 0 HB3 LYS A 878 14.952 -37.058 21.225 1.00 42.43 H new ATOM 0 HG2 LYS A 878 15.436 -38.846 19.821 1.00 5.33 H new ATOM 0 HG3 LYS A 878 15.926 -37.815 18.491 1.00 5.33 H new ATOM 0 HD2 LYS A 878 18.112 -37.558 19.299 1.00 74.04 H new ATOM 0 HD3 LYS A 878 17.640 -37.792 20.971 1.00 74.04 H new ATOM 0 HE2 LYS A 878 18.899 -39.756 20.195 1.00 34.15 H new ATOM 0 HE3 LYS A 878 17.242 -40.221 20.524 1.00 34.15 H new ATOM 0 HZ1 LYS A 878 18.128 -41.071 18.395 1.00 73.34 H new ATOM 0 HZ2 LYS A 878 16.723 -40.135 18.210 1.00 73.34 H new ATOM 0 HZ3 LYS A 878 18.240 -39.475 17.826 1.00 73.34 H new ATOM 1410 N TYR A 879 13.899 -37.154 17.329 1.00 32.21 N ATOM 1411 CA TYR A 879 13.179 -38.038 16.428 1.00 31.00 C ATOM 1412 C TYR A 879 14.103 -39.121 15.868 1.00 42.15 C ATOM 1413 O TYR A 879 15.324 -39.016 15.973 1.00 1.41 O ATOM 1414 CB TYR A 879 12.688 -37.158 15.277 1.00 12.31 C ATOM 1415 CG TYR A 879 11.746 -37.872 14.306 1.00 40.14 C ATOM 1416 CD1 TYR A 879 10.801 -38.756 14.785 1.00 60.30 C ATOM 1417 CD2 TYR A 879 11.841 -37.632 12.950 1.00 44.21 C ATOM 1418 CE1 TYR A 879 9.915 -39.428 13.871 1.00 74.44 C ATOM 1419 CE2 TYR A 879 10.955 -38.304 12.036 1.00 51.14 C ATOM 1420 CZ TYR A 879 10.035 -39.169 12.541 1.00 23.00 C ATOM 1421 OH TYR A 879 9.198 -39.804 11.678 1.00 41.15 O ATOM 0 H TYR A 879 14.700 -36.679 16.912 1.00 32.21 H new ATOM 0 HA TYR A 879 12.363 -38.537 16.951 1.00 31.00 H new ATOM 0 HB2 TYR A 879 12.176 -36.289 15.690 1.00 12.31 H new ATOM 0 HB3 TYR A 879 13.551 -36.787 14.724 1.00 12.31 H new ATOM 0 HD1 TYR A 879 10.726 -38.944 15.846 1.00 60.30 H new ATOM 0 HD2 TYR A 879 12.580 -36.940 12.575 1.00 44.21 H new ATOM 0 HE1 TYR A 879 9.171 -40.122 14.233 1.00 74.44 H new ATOM 0 HE2 TYR A 879 11.019 -38.125 10.973 1.00 51.14 H new ATOM 0 HH TYR A 879 8.953 -40.679 12.044 1.00 41.15 H new ATOM 1431 N LYS A 880 13.485 -40.137 15.284 1.00 63.23 N ATOM 1432 CA LYS A 880 14.237 -41.238 14.706 1.00 23.45 C ATOM 1433 C LYS A 880 15.437 -40.683 13.937 1.00 42.23 C ATOM 1434 O LYS A 880 15.277 -40.108 12.861 1.00 61.41 O ATOM 1435 CB LYS A 880 13.322 -42.127 13.861 1.00 24.13 C ATOM 1436 CG LYS A 880 12.709 -43.245 14.708 1.00 41.53 C ATOM 1437 CD LYS A 880 11.860 -42.669 15.843 1.00 24.34 C ATOM 1438 CE LYS A 880 10.535 -42.119 15.313 1.00 60.21 C ATOM 1439 NZ LYS A 880 9.978 -41.118 16.249 1.00 13.42 N ATOM 0 H LYS A 880 12.472 -40.221 15.199 1.00 63.23 H new ATOM 0 HA LYS A 880 14.632 -41.883 15.491 1.00 23.45 H new ATOM 0 HB2 LYS A 880 12.529 -41.523 13.420 1.00 24.13 H new ATOM 0 HB3 LYS A 880 13.889 -42.560 13.037 1.00 24.13 H new ATOM 0 HG2 LYS A 880 12.093 -43.887 14.078 1.00 41.53 H new ATOM 0 HG3 LYS A 880 13.501 -43.869 15.122 1.00 41.53 H new ATOM 0 HD2 LYS A 880 11.665 -43.443 16.585 1.00 24.34 H new ATOM 0 HD3 LYS A 880 12.411 -41.875 16.347 1.00 24.34 H new ATOM 0 HE2 LYS A 880 10.689 -41.664 14.334 1.00 60.21 H new ATOM 0 HE3 LYS A 880 9.824 -42.934 15.178 1.00 60.21 H new ATOM 0 HZ1 LYS A 880 9.052 -41.442 16.593 1.00 13.42 H new ATOM 0 HZ2 LYS A 880 10.624 -40.999 17.055 1.00 13.42 H new ATOM 0 HZ3 LYS A 880 9.866 -40.208 15.758 1.00 13.42 H new ATOM 1452 N THR A 881 16.612 -40.873 14.518 1.00 23.51 N ATOM 1453 CA THR A 881 17.839 -40.399 13.900 1.00 12.43 C ATOM 1454 C THR A 881 17.589 -39.081 13.164 1.00 43.02 C ATOM 1455 O THR A 881 18.126 -38.861 12.079 1.00 2.43 O ATOM 1456 CB THR A 881 18.373 -41.510 12.994 1.00 14.30 C ATOM 1457 OG1 THR A 881 19.736 -41.156 12.778 1.00 71.15 O ATOM 1458 CG2 THR A 881 17.752 -41.474 11.596 1.00 11.00 C ATOM 0 H THR A 881 16.741 -41.349 15.411 1.00 23.51 H new ATOM 0 HA THR A 881 18.600 -40.178 14.649 1.00 12.43 H new ATOM 0 HB THR A 881 18.177 -42.479 13.453 1.00 14.30 H new ATOM 0 HG1 THR A 881 19.782 -40.271 12.360 1.00 71.15 H new ATOM 0 HG21 THR A 881 18.165 -42.283 10.993 1.00 11.00 H new ATOM 0 HG22 THR A 881 16.672 -41.595 11.675 1.00 11.00 H new ATOM 0 HG23 THR A 881 17.976 -40.518 11.123 1.00 11.00 H new ATOM 1466 N PHE A 882 16.774 -38.239 13.783 1.00 64.34 N ATOM 1467 CA PHE A 882 16.447 -36.949 13.199 1.00 22.34 C ATOM 1468 C PHE A 882 16.257 -35.889 14.286 1.00 44.33 C ATOM 1469 O PHE A 882 15.844 -36.204 15.400 1.00 14.23 O ATOM 1470 CB PHE A 882 15.132 -37.123 12.438 1.00 73.41 C ATOM 1471 CG PHE A 882 15.245 -38.008 11.194 1.00 11.53 C ATOM 1472 CD1 PHE A 882 16.346 -37.926 10.400 1.00 20.53 C ATOM 1473 CD2 PHE A 882 14.244 -38.875 10.883 1.00 43.50 C ATOM 1474 CE1 PHE A 882 16.451 -38.747 9.246 1.00 21.11 C ATOM 1475 CE2 PHE A 882 14.349 -39.695 9.729 1.00 64.01 C ATOM 1476 CZ PHE A 882 15.451 -39.614 8.935 1.00 75.02 C ATOM 0 H PHE A 882 16.331 -38.425 14.683 1.00 64.34 H new ATOM 0 HA PHE A 882 17.255 -36.621 12.545 1.00 22.34 H new ATOM 0 HB2 PHE A 882 14.389 -37.552 13.110 1.00 73.41 H new ATOM 0 HB3 PHE A 882 14.764 -36.141 12.141 1.00 73.41 H new ATOM 0 HD1 PHE A 882 17.140 -37.237 10.647 1.00 20.53 H new ATOM 0 HD2 PHE A 882 13.370 -38.939 11.514 1.00 43.50 H new ATOM 0 HE1 PHE A 882 17.325 -38.683 8.615 1.00 21.11 H new ATOM 0 HE2 PHE A 882 13.554 -40.383 9.481 1.00 64.01 H new ATOM 0 HZ PHE A 882 15.531 -40.239 8.058 1.00 75.02 H new ATOM 1486 N GLU A 883 16.569 -34.653 13.923 1.00 61.24 N ATOM 1487 CA GLU A 883 16.438 -33.544 14.852 1.00 21.34 C ATOM 1488 C GLU A 883 15.432 -32.522 14.321 1.00 51.24 C ATOM 1489 O GLU A 883 15.760 -31.719 13.449 1.00 53.44 O ATOM 1490 CB GLU A 883 17.795 -32.890 15.120 1.00 30.12 C ATOM 1491 CG GLU A 883 17.707 -31.902 16.285 1.00 20.44 C ATOM 1492 CD GLU A 883 19.055 -31.221 16.529 1.00 10.22 C ATOM 1493 OE1 GLU A 883 19.136 -29.983 16.514 1.00 34.55 O ATOM 1494 OE2 GLU A 883 20.042 -32.024 16.741 1.00 71.12 O ATOM 0 H GLU A 883 16.912 -34.396 12.998 1.00 61.24 H new ATOM 0 HA GLU A 883 16.065 -33.932 15.800 1.00 21.34 H new ATOM 0 HB2 GLU A 883 18.535 -33.658 15.345 1.00 30.12 H new ATOM 0 HB3 GLU A 883 18.136 -32.372 14.224 1.00 30.12 H new ATOM 0 HG2 GLU A 883 16.948 -31.149 16.071 1.00 20.44 H new ATOM 0 HG3 GLU A 883 17.391 -32.425 17.187 1.00 20.44 H new ATOM 1502 N ILE A 884 14.227 -32.585 14.868 1.00 0.21 N ATOM 1503 CA ILE A 884 13.171 -31.674 14.460 1.00 72.33 C ATOM 1504 C ILE A 884 12.215 -31.450 15.633 1.00 73.21 C ATOM 1505 O ILE A 884 11.971 -32.361 16.423 1.00 63.12 O ATOM 1506 CB ILE A 884 12.481 -32.187 13.194 1.00 43.03 C ATOM 1507 CG1 ILE A 884 12.655 -33.700 13.049 1.00 23.21 C ATOM 1508 CG2 ILE A 884 12.974 -31.433 11.957 1.00 2.42 C ATOM 1509 CD1 ILE A 884 11.926 -34.445 14.169 1.00 24.41 C ATOM 0 H ILE A 884 13.958 -33.253 15.591 1.00 0.21 H new ATOM 0 HA ILE A 884 13.587 -30.701 14.197 1.00 72.33 H new ATOM 0 HB ILE A 884 11.412 -31.993 13.285 1.00 43.03 H new ATOM 0 HG12 ILE A 884 12.270 -34.023 12.082 1.00 23.21 H new ATOM 0 HG13 ILE A 884 13.715 -33.952 13.070 1.00 23.21 H new ATOM 0 HG21 ILE A 884 12.468 -31.817 11.071 1.00 2.42 H new ATOM 0 HG22 ILE A 884 12.756 -30.371 12.068 1.00 2.42 H new ATOM 0 HG23 ILE A 884 14.050 -31.574 11.850 1.00 2.42 H new ATOM 0 HD11 ILE A 884 12.065 -35.519 14.043 1.00 24.41 H new ATOM 0 HD12 ILE A 884 12.330 -34.138 15.134 1.00 24.41 H new ATOM 0 HD13 ILE A 884 10.862 -34.210 14.130 1.00 24.41 H new ATOM 1521 N PRO A 885 11.685 -30.200 15.712 1.00 72.21 N ATOM 1522 CA PRO A 885 10.761 -29.845 16.775 1.00 12.23 C ATOM 1523 C PRO A 885 9.379 -30.452 16.527 1.00 73.43 C ATOM 1524 O PRO A 885 9.078 -30.886 15.416 1.00 40.04 O ATOM 1525 CB PRO A 885 10.747 -28.325 16.793 1.00 40.00 C ATOM 1526 CG PRO A 885 11.299 -27.887 15.446 1.00 75.53 C ATOM 1527 CD PRO A 885 11.950 -29.096 14.794 1.00 24.12 C ATOM 0 HA PRO A 885 11.065 -30.239 17.745 1.00 12.23 H new ATOM 0 HB2 PRO A 885 9.736 -27.946 16.943 1.00 40.00 H new ATOM 0 HB3 PRO A 885 11.357 -27.938 17.609 1.00 40.00 H new ATOM 0 HG2 PRO A 885 10.501 -27.497 14.815 1.00 75.53 H new ATOM 0 HG3 PRO A 885 12.026 -27.085 15.574 1.00 75.53 H new ATOM 0 HD2 PRO A 885 11.527 -29.290 13.808 1.00 24.12 H new ATOM 0 HD3 PRO A 885 13.021 -28.943 14.657 1.00 24.12 H new ATOM 1535 N VAL A 886 8.575 -30.464 17.580 1.00 73.33 N ATOM 1536 CA VAL A 886 7.232 -31.011 17.490 1.00 74.44 C ATOM 1537 C VAL A 886 6.214 -29.901 17.760 1.00 22.23 C ATOM 1538 O VAL A 886 6.121 -29.399 18.879 1.00 30.02 O ATOM 1539 CB VAL A 886 7.086 -32.201 18.441 1.00 1.32 C ATOM 1540 CG1 VAL A 886 5.855 -33.037 18.089 1.00 74.33 C ATOM 1541 CG2 VAL A 886 8.352 -33.061 18.441 1.00 14.45 C ATOM 0 H VAL A 886 8.828 -30.104 18.500 1.00 73.33 H new ATOM 0 HA VAL A 886 7.041 -31.390 16.486 1.00 74.44 H new ATOM 0 HB VAL A 886 6.947 -31.809 19.449 1.00 1.32 H new ATOM 0 HG11 VAL A 886 5.775 -33.876 18.780 1.00 74.33 H new ATOM 0 HG12 VAL A 886 4.961 -32.418 18.165 1.00 74.33 H new ATOM 0 HG13 VAL A 886 5.950 -33.414 17.071 1.00 74.33 H new ATOM 0 HG21 VAL A 886 8.222 -33.900 19.125 1.00 14.45 H new ATOM 0 HG22 VAL A 886 8.536 -33.438 17.435 1.00 14.45 H new ATOM 0 HG23 VAL A 886 9.201 -32.458 18.763 1.00 14.45 H new ATOM 1551 N ILE A 887 5.477 -29.551 16.717 1.00 40.34 N ATOM 1552 CA ILE A 887 4.470 -28.509 16.828 1.00 71.23 C ATOM 1553 C ILE A 887 3.081 -29.150 16.857 1.00 31.03 C ATOM 1554 O ILE A 887 2.956 -30.372 16.799 1.00 31.31 O ATOM 1555 CB ILE A 887 4.646 -27.473 15.716 1.00 74.24 C ATOM 1556 CG1 ILE A 887 6.119 -27.325 15.332 1.00 5.35 C ATOM 1557 CG2 ILE A 887 4.018 -26.134 16.109 1.00 30.53 C ATOM 1558 CD1 ILE A 887 6.943 -26.806 16.513 1.00 42.32 C ATOM 0 H ILE A 887 5.557 -29.970 15.791 1.00 40.34 H new ATOM 0 HA ILE A 887 4.589 -27.962 17.763 1.00 71.23 H new ATOM 0 HB ILE A 887 4.118 -27.829 14.832 1.00 74.24 H new ATOM 0 HG12 ILE A 887 6.512 -28.288 15.005 1.00 5.35 H new ATOM 0 HG13 ILE A 887 6.212 -26.640 14.490 1.00 5.35 H new ATOM 0 HG21 ILE A 887 4.157 -25.416 15.301 1.00 30.53 H new ATOM 0 HG22 ILE A 887 2.952 -26.272 16.292 1.00 30.53 H new ATOM 0 HG23 ILE A 887 4.496 -25.759 17.014 1.00 30.53 H new ATOM 0 HD11 ILE A 887 7.987 -26.710 16.214 1.00 42.32 H new ATOM 0 HD12 ILE A 887 6.563 -25.832 16.822 1.00 42.32 H new ATOM 0 HD13 ILE A 887 6.867 -27.506 17.345 1.00 42.32 H new ATOM 1570 N LYS A 888 2.072 -28.296 16.948 1.00 41.02 N ATOM 1571 CA LYS A 888 0.697 -28.764 16.986 1.00 52.51 C ATOM 1572 C LYS A 888 -0.058 -28.214 15.774 1.00 62.35 C ATOM 1573 O LYS A 888 0.554 -27.712 14.832 1.00 3.34 O ATOM 1574 CB LYS A 888 0.048 -28.411 18.326 1.00 52.42 C ATOM 1575 CG LYS A 888 1.080 -28.423 19.455 1.00 2.31 C ATOM 1576 CD LYS A 888 1.542 -27.003 19.791 1.00 62.32 C ATOM 1577 CE LYS A 888 1.544 -26.771 21.303 1.00 43.30 C ATOM 1578 NZ LYS A 888 0.470 -25.827 21.684 1.00 74.03 N ATOM 0 H LYS A 888 2.179 -27.283 16.997 1.00 41.02 H new ATOM 0 HA LYS A 888 0.663 -29.851 16.917 1.00 52.51 H new ATOM 0 HB2 LYS A 888 -0.415 -27.426 18.262 1.00 52.42 H new ATOM 0 HB3 LYS A 888 -0.747 -29.123 18.548 1.00 52.42 H new ATOM 0 HG2 LYS A 888 0.649 -28.888 20.341 1.00 2.31 H new ATOM 0 HG3 LYS A 888 1.938 -29.029 19.162 1.00 2.31 H new ATOM 0 HD2 LYS A 888 2.543 -26.839 19.393 1.00 62.32 H new ATOM 0 HD3 LYS A 888 0.885 -26.279 19.309 1.00 62.32 H new ATOM 0 HE2 LYS A 888 1.404 -27.719 21.822 1.00 43.30 H new ATOM 0 HE3 LYS A 888 2.511 -26.376 21.615 1.00 43.30 H new ATOM 0 HZ1 LYS A 888 0.486 -25.681 22.714 1.00 74.03 H new ATOM 0 HZ2 LYS A 888 0.620 -24.917 21.203 1.00 74.03 H new ATOM 0 HZ3 LYS A 888 -0.452 -26.219 21.404 1.00 74.03 H new ATOM 1591 N ILE A 889 -1.376 -28.329 15.836 1.00 52.23 N ATOM 1592 CA ILE A 889 -2.221 -27.850 14.755 1.00 42.14 C ATOM 1593 C ILE A 889 -2.647 -26.409 15.046 1.00 63.54 C ATOM 1594 O ILE A 889 -2.689 -25.576 14.142 1.00 64.22 O ATOM 1595 CB ILE A 889 -3.395 -28.805 14.529 1.00 41.32 C ATOM 1596 CG1 ILE A 889 -4.275 -28.328 13.372 1.00 42.45 C ATOM 1597 CG2 ILE A 889 -4.198 -29.000 15.816 1.00 22.34 C ATOM 1598 CD1 ILE A 889 -3.783 -28.896 12.039 1.00 50.43 C ATOM 0 H ILE A 889 -1.880 -28.747 16.618 1.00 52.23 H new ATOM 0 HA ILE A 889 -1.667 -27.835 13.816 1.00 42.14 H new ATOM 0 HB ILE A 889 -2.994 -29.779 14.248 1.00 41.32 H new ATOM 0 HG12 ILE A 889 -5.306 -28.636 13.544 1.00 42.45 H new ATOM 0 HG13 ILE A 889 -4.270 -27.239 13.331 1.00 42.45 H new ATOM 0 HG21 ILE A 889 -5.026 -29.683 15.628 1.00 22.34 H new ATOM 0 HG22 ILE A 889 -3.552 -29.417 16.588 1.00 22.34 H new ATOM 0 HG23 ILE A 889 -4.589 -28.039 16.150 1.00 22.34 H new ATOM 0 HD11 ILE A 889 -4.426 -28.542 11.233 1.00 50.43 H new ATOM 0 HD12 ILE A 889 -2.760 -28.567 11.859 1.00 50.43 H new ATOM 0 HD13 ILE A 889 -3.813 -29.985 12.074 1.00 50.43 H new ATOM 1610 N GLU A 890 -2.952 -26.161 16.311 1.00 41.44 N ATOM 1611 CA GLU A 890 -3.373 -24.835 16.732 1.00 30.31 C ATOM 1612 C GLU A 890 -2.162 -24.007 17.167 1.00 14.01 C ATOM 1613 O GLU A 890 -2.253 -23.213 18.102 1.00 3.01 O ATOM 1614 CB GLU A 890 -4.411 -24.920 17.853 1.00 25.43 C ATOM 1615 CG GLU A 890 -3.803 -25.532 19.117 1.00 1.13 C ATOM 1616 CD GLU A 890 -4.695 -25.276 20.334 1.00 73.24 C ATOM 1617 OE1 GLU A 890 -5.910 -25.517 20.273 1.00 52.03 O ATOM 1618 OE2 GLU A 890 -4.084 -24.811 21.370 1.00 32.11 O ATOM 0 H GLU A 890 -2.916 -26.855 17.058 1.00 41.44 H new ATOM 0 HA GLU A 890 -3.843 -24.337 15.884 1.00 30.31 H new ATOM 0 HB2 GLU A 890 -4.794 -23.924 18.075 1.00 25.43 H new ATOM 0 HB3 GLU A 890 -5.258 -25.522 17.524 1.00 25.43 H new ATOM 0 HG2 GLU A 890 -3.670 -26.605 18.978 1.00 1.13 H new ATOM 0 HG3 GLU A 890 -2.814 -25.108 19.291 1.00 1.13 H new ATOM 1626 N SER A 891 -1.057 -24.220 16.468 1.00 74.51 N ATOM 1627 CA SER A 891 0.170 -23.503 16.770 1.00 33.52 C ATOM 1628 C SER A 891 0.350 -22.340 15.793 1.00 64.32 C ATOM 1629 O SER A 891 1.105 -21.408 16.065 1.00 53.51 O ATOM 1630 CB SER A 891 1.381 -24.437 16.714 1.00 12.44 C ATOM 1631 OG SER A 891 2.476 -23.936 17.477 1.00 60.15 O ATOM 0 H SER A 891 -0.986 -24.879 15.693 1.00 74.51 H new ATOM 0 HA SER A 891 0.096 -23.109 17.784 1.00 33.52 H new ATOM 0 HB2 SER A 891 1.098 -25.421 17.088 1.00 12.44 H new ATOM 0 HB3 SER A 891 1.691 -24.568 15.677 1.00 12.44 H new ATOM 0 HG SER A 891 2.810 -24.640 18.072 1.00 60.15 H new ATOM 1637 N PHE A 892 -0.355 -22.434 14.675 1.00 44.40 N ATOM 1638 CA PHE A 892 -0.282 -21.401 13.656 1.00 44.34 C ATOM 1639 C PHE A 892 -1.476 -21.484 12.704 1.00 75.33 C ATOM 1640 O PHE A 892 -2.181 -22.492 12.673 1.00 62.21 O ATOM 1641 CB PHE A 892 1.004 -21.644 12.863 1.00 25.25 C ATOM 1642 CG PHE A 892 1.365 -23.122 12.702 1.00 63.41 C ATOM 1643 CD1 PHE A 892 0.476 -23.981 12.136 1.00 71.51 C ATOM 1644 CD2 PHE A 892 2.575 -23.577 13.124 1.00 5.03 C ATOM 1645 CE1 PHE A 892 0.811 -25.353 11.986 1.00 72.32 C ATOM 1646 CE2 PHE A 892 2.910 -24.949 12.974 1.00 3.33 C ATOM 1647 CZ PHE A 892 2.021 -25.808 12.408 1.00 10.12 C ATOM 0 H PHE A 892 -0.979 -23.209 14.453 1.00 44.40 H new ATOM 0 HA PHE A 892 -0.292 -20.417 14.124 1.00 44.34 H new ATOM 0 HB2 PHE A 892 0.900 -21.196 11.875 1.00 25.25 H new ATOM 0 HB3 PHE A 892 1.828 -21.131 13.360 1.00 25.25 H new ATOM 0 HD1 PHE A 892 -0.485 -23.620 11.800 1.00 71.51 H new ATOM 0 HD2 PHE A 892 3.281 -22.895 13.573 1.00 5.03 H new ATOM 0 HE1 PHE A 892 0.105 -26.035 11.537 1.00 72.32 H new ATOM 0 HE2 PHE A 892 3.871 -25.310 13.310 1.00 3.33 H new ATOM 0 HZ PHE A 892 2.276 -26.851 12.294 1.00 10.12 H new ATOM 1657 N VAL A 893 -1.668 -20.412 11.950 1.00 11.51 N ATOM 1658 CA VAL A 893 -2.766 -20.351 11.000 1.00 44.13 C ATOM 1659 C VAL A 893 -2.262 -20.775 9.618 1.00 15.15 C ATOM 1660 O VAL A 893 -1.059 -20.914 9.408 1.00 24.43 O ATOM 1661 CB VAL A 893 -3.387 -18.953 11.006 1.00 10.34 C ATOM 1662 CG1 VAL A 893 -3.365 -18.350 12.412 1.00 14.14 C ATOM 1663 CG2 VAL A 893 -2.683 -18.035 10.005 1.00 4.13 C ATOM 0 H VAL A 893 -1.081 -19.578 11.978 1.00 11.51 H new ATOM 0 HA VAL A 893 -3.557 -21.044 11.286 1.00 44.13 H new ATOM 0 HB VAL A 893 -4.428 -19.048 10.698 1.00 10.34 H new ATOM 0 HG11 VAL A 893 -3.812 -17.356 12.389 1.00 14.14 H new ATOM 0 HG12 VAL A 893 -3.932 -18.987 13.090 1.00 14.14 H new ATOM 0 HG13 VAL A 893 -2.335 -18.276 12.760 1.00 14.14 H new ATOM 0 HG21 VAL A 893 -3.144 -17.048 10.030 1.00 4.13 H new ATOM 0 HG22 VAL A 893 -1.629 -17.950 10.269 1.00 4.13 H new ATOM 0 HG23 VAL A 893 -2.774 -18.453 9.002 1.00 4.13 H new ATOM 1673 N VAL A 894 -3.210 -20.968 8.712 1.00 3.15 N ATOM 1674 CA VAL A 894 -2.878 -21.373 7.357 1.00 24.22 C ATOM 1675 C VAL A 894 -3.384 -20.316 6.375 1.00 54.44 C ATOM 1676 O VAL A 894 -4.587 -20.207 6.139 1.00 22.50 O ATOM 1677 CB VAL A 894 -3.439 -22.768 7.076 1.00 61.52 C ATOM 1678 CG1 VAL A 894 -2.509 -23.557 6.152 1.00 70.41 C ATOM 1679 CG2 VAL A 894 -3.693 -23.530 8.378 1.00 14.12 C ATOM 0 H VAL A 894 -4.208 -20.851 8.890 1.00 3.15 H new ATOM 0 HA VAL A 894 -1.797 -21.441 7.232 1.00 24.22 H new ATOM 0 HB VAL A 894 -4.395 -22.648 6.566 1.00 61.52 H new ATOM 0 HG11 VAL A 894 -2.931 -24.545 5.968 1.00 70.41 H new ATOM 0 HG12 VAL A 894 -2.401 -23.027 5.206 1.00 70.41 H new ATOM 0 HG13 VAL A 894 -1.532 -23.662 6.623 1.00 70.41 H new ATOM 0 HG21 VAL A 894 -4.092 -24.518 8.149 1.00 14.12 H new ATOM 0 HG22 VAL A 894 -2.757 -23.634 8.927 1.00 14.12 H new ATOM 0 HG23 VAL A 894 -4.412 -22.981 8.987 1.00 14.12 H new ATOM 1689 N GLU A 895 -2.442 -19.562 5.828 1.00 62.03 N ATOM 1690 CA GLU A 895 -2.778 -18.517 4.876 1.00 42.31 C ATOM 1691 C GLU A 895 -2.251 -18.876 3.485 1.00 74.10 C ATOM 1692 O GLU A 895 -1.042 -18.950 3.275 1.00 4.51 O ATOM 1693 CB GLU A 895 -2.234 -17.162 5.335 1.00 72.23 C ATOM 1694 CG GLU A 895 -2.864 -16.019 4.536 1.00 74.51 C ATOM 1695 CD GLU A 895 -2.643 -14.676 5.233 1.00 11.25 C ATOM 1696 OE1 GLU A 895 -1.491 -14.257 5.422 1.00 71.43 O ATOM 1697 OE2 GLU A 895 -3.721 -14.059 5.584 1.00 63.23 O ATOM 0 H GLU A 895 -1.446 -19.654 6.026 1.00 62.03 H new ATOM 0 HA GLU A 895 -3.864 -18.437 4.822 1.00 42.31 H new ATOM 0 HB2 GLU A 895 -2.439 -17.025 6.397 1.00 72.23 H new ATOM 0 HB3 GLU A 895 -1.151 -17.141 5.214 1.00 72.23 H new ATOM 0 HG2 GLU A 895 -2.432 -15.989 3.536 1.00 74.51 H new ATOM 0 HG3 GLU A 895 -3.932 -16.199 4.417 1.00 74.51 H new ATOM 1705 N ASP A 896 -3.186 -19.091 2.571 1.00 50.32 N ATOM 1706 CA ASP A 896 -2.831 -19.441 1.206 1.00 54.42 C ATOM 1707 C ASP A 896 -2.138 -18.249 0.542 1.00 32.11 C ATOM 1708 O ASP A 896 -2.484 -17.099 0.807 1.00 5.34 O ATOM 1709 CB ASP A 896 -4.076 -19.782 0.384 1.00 42.43 C ATOM 1710 CG ASP A 896 -4.101 -21.198 -0.194 1.00 31.20 C ATOM 1711 OD1 ASP A 896 -3.235 -21.576 -0.997 1.00 10.00 O ATOM 1712 OD2 ASP A 896 -5.074 -21.938 0.218 1.00 13.23 O ATOM 0 H ASP A 896 -4.188 -19.030 2.749 1.00 50.32 H new ATOM 0 HA ASP A 896 -2.172 -20.309 1.241 1.00 54.42 H new ATOM 0 HB2 ASP A 896 -4.956 -19.647 1.012 1.00 42.43 H new ATOM 0 HB3 ASP A 896 -4.158 -19.069 -0.437 1.00 42.43 H new ATOM 1718 N ILE A 897 -1.173 -18.565 -0.308 1.00 63.53 N ATOM 1719 CA ILE A 897 -0.428 -17.535 -1.012 1.00 61.30 C ATOM 1720 C ILE A 897 -1.149 -17.192 -2.317 1.00 13.22 C ATOM 1721 O ILE A 897 -0.830 -16.195 -2.963 1.00 65.54 O ATOM 1722 CB ILE A 897 1.027 -17.966 -1.209 1.00 0.23 C ATOM 1723 CG1 ILE A 897 1.501 -18.843 -0.048 1.00 10.10 C ATOM 1724 CG2 ILE A 897 1.935 -16.752 -1.418 1.00 14.25 C ATOM 1725 CD1 ILE A 897 1.615 -20.307 -0.478 1.00 44.31 C ATOM 0 H ILE A 897 -0.889 -19.520 -0.526 1.00 63.53 H new ATOM 0 HA ILE A 897 -0.388 -16.621 -0.419 1.00 61.30 H new ATOM 0 HB ILE A 897 1.085 -18.571 -2.114 1.00 0.23 H new ATOM 0 HG12 ILE A 897 2.468 -18.489 0.309 1.00 10.10 H new ATOM 0 HG13 ILE A 897 0.803 -18.758 0.785 1.00 10.10 H new ATOM 0 HG21 ILE A 897 2.963 -17.086 -1.555 1.00 14.25 H new ATOM 0 HG22 ILE A 897 1.611 -16.203 -2.302 1.00 14.25 H new ATOM 0 HG23 ILE A 897 1.879 -16.101 -0.546 1.00 14.25 H new ATOM 0 HD11 ILE A 897 1.954 -20.909 0.365 1.00 44.31 H new ATOM 0 HD12 ILE A 897 0.641 -20.665 -0.811 1.00 44.31 H new ATOM 0 HD13 ILE A 897 2.332 -20.392 -1.295 1.00 44.31 H new ATOM 1737 N ALA A 898 -2.109 -18.036 -2.665 1.00 32.11 N ATOM 1738 CA ALA A 898 -2.879 -17.834 -3.881 1.00 24.40 C ATOM 1739 C ALA A 898 -4.247 -17.251 -3.523 1.00 2.13 C ATOM 1740 O ALA A 898 -5.055 -16.967 -4.405 1.00 71.44 O ATOM 1741 CB ALA A 898 -2.990 -19.158 -4.640 1.00 61.03 C ATOM 0 H ALA A 898 -2.371 -18.861 -2.126 1.00 32.11 H new ATOM 0 HA ALA A 898 -2.379 -17.122 -4.538 1.00 24.40 H new ATOM 0 HB1 ALA A 898 -3.567 -19.007 -5.552 1.00 61.03 H new ATOM 0 HB2 ALA A 898 -1.993 -19.515 -4.897 1.00 61.03 H new ATOM 0 HB3 ALA A 898 -3.489 -19.896 -4.013 1.00 61.03 H new ATOM 1747 N THR A 899 -4.464 -17.089 -2.226 1.00 12.12 N ATOM 1748 CA THR A 899 -5.721 -16.544 -1.740 1.00 23.21 C ATOM 1749 C THR A 899 -5.467 -15.538 -0.616 1.00 25.12 C ATOM 1750 O THR A 899 -6.014 -14.437 -0.628 1.00 43.53 O ATOM 1751 CB THR A 899 -6.612 -17.714 -1.318 1.00 65.41 C ATOM 1752 OG1 THR A 899 -6.097 -18.102 -0.047 1.00 12.41 O ATOM 1753 CG2 THR A 899 -6.408 -18.951 -2.195 1.00 65.51 C ATOM 0 H THR A 899 -3.791 -17.325 -1.497 1.00 12.12 H new ATOM 0 HA THR A 899 -6.239 -15.987 -2.521 1.00 23.21 H new ATOM 0 HB THR A 899 -7.657 -17.407 -1.360 1.00 65.41 H new ATOM 0 HG1 THR A 899 -6.777 -18.613 0.439 1.00 12.41 H new ATOM 0 HG21 THR A 899 -7.064 -19.752 -1.853 1.00 65.51 H new ATOM 0 HG22 THR A 899 -6.644 -18.706 -3.230 1.00 65.51 H new ATOM 0 HG23 THR A 899 -5.370 -19.278 -2.127 1.00 65.51 H new ATOM 1761 N GLY A 900 -4.636 -15.953 0.329 1.00 1.35 N ATOM 1762 CA GLY A 900 -4.302 -15.101 1.459 1.00 75.41 C ATOM 1763 C GLY A 900 -5.284 -15.312 2.613 1.00 35.21 C ATOM 1764 O GLY A 900 -5.242 -14.591 3.609 1.00 65.32 O ATOM 0 H GLY A 900 -4.184 -16.867 0.336 1.00 1.35 H new ATOM 0 HA2 GLY A 900 -3.288 -15.318 1.795 1.00 75.41 H new ATOM 0 HA3 GLY A 900 -4.319 -14.056 1.149 1.00 75.41 H new ATOM 1768 N VAL A 901 -6.146 -16.304 2.441 1.00 14.41 N ATOM 1769 CA VAL A 901 -7.137 -16.618 3.456 1.00 34.30 C ATOM 1770 C VAL A 901 -6.470 -17.401 4.589 1.00 11.50 C ATOM 1771 O VAL A 901 -6.019 -18.527 4.388 1.00 23.15 O ATOM 1772 CB VAL A 901 -8.313 -17.366 2.825 1.00 75.41 C ATOM 1773 CG1 VAL A 901 -9.442 -17.568 3.838 1.00 71.00 C ATOM 1774 CG2 VAL A 901 -8.820 -16.640 1.577 1.00 4.44 C ATOM 0 H VAL A 901 -6.178 -16.900 1.614 1.00 14.41 H new ATOM 0 HA VAL A 901 -7.544 -15.704 3.888 1.00 34.30 H new ATOM 0 HB VAL A 901 -7.957 -18.350 2.519 1.00 75.41 H new ATOM 0 HG11 VAL A 901 -10.265 -18.102 3.364 1.00 71.00 H new ATOM 0 HG12 VAL A 901 -9.073 -18.148 4.684 1.00 71.00 H new ATOM 0 HG13 VAL A 901 -9.793 -16.598 4.189 1.00 71.00 H new ATOM 0 HG21 VAL A 901 -9.656 -17.193 1.149 1.00 4.44 H new ATOM 0 HG22 VAL A 901 -9.150 -15.637 1.848 1.00 4.44 H new ATOM 0 HG23 VAL A 901 -8.016 -16.572 0.844 1.00 4.44 H new ATOM 1784 N GLN A 902 -6.429 -16.772 5.755 1.00 63.14 N ATOM 1785 CA GLN A 902 -5.824 -17.395 6.920 1.00 70.12 C ATOM 1786 C GLN A 902 -6.884 -18.142 7.733 1.00 42.54 C ATOM 1787 O GLN A 902 -8.031 -17.705 7.813 1.00 60.13 O ATOM 1788 CB GLN A 902 -5.101 -16.359 7.782 1.00 2.13 C ATOM 1789 CG GLN A 902 -5.980 -15.129 8.015 1.00 54.11 C ATOM 1790 CD GLN A 902 -5.597 -14.418 9.314 1.00 21.35 C ATOM 1791 OE1 GLN A 902 -6.427 -13.870 10.021 1.00 60.21 O ATOM 1792 NE2 GLN A 902 -4.296 -14.458 9.589 1.00 32.23 N ATOM 0 H GLN A 902 -6.805 -15.838 5.918 1.00 63.14 H new ATOM 0 HA GLN A 902 -5.082 -18.116 6.578 1.00 70.12 H new ATOM 0 HB2 GLN A 902 -4.830 -16.803 8.740 1.00 2.13 H new ATOM 0 HB3 GLN A 902 -4.173 -16.060 7.295 1.00 2.13 H new ATOM 0 HG2 GLN A 902 -5.878 -14.441 7.176 1.00 54.11 H new ATOM 0 HG3 GLN A 902 -7.027 -15.429 8.056 1.00 54.11 H new ATOM 0 HE21 GLN A 902 -3.655 -14.934 8.954 1.00 32.23 H new ATOM 0 HE22 GLN A 902 -3.940 -14.013 10.435 1.00 32.23 H new ATOM 1801 N THR A 903 -6.462 -19.254 8.315 1.00 22.21 N ATOM 1802 CA THR A 903 -7.360 -20.065 9.119 1.00 74.32 C ATOM 1803 C THR A 903 -6.604 -20.701 10.287 1.00 60.11 C ATOM 1804 O THR A 903 -5.401 -20.940 10.195 1.00 21.43 O ATOM 1805 CB THR A 903 -8.026 -21.089 8.197 1.00 43.13 C ATOM 1806 OG1 THR A 903 -9.407 -21.021 8.541 1.00 4.15 O ATOM 1807 CG2 THR A 903 -7.628 -22.527 8.534 1.00 22.25 C ATOM 0 H THR A 903 -5.510 -19.613 8.246 1.00 22.21 H new ATOM 0 HA THR A 903 -8.142 -19.456 9.572 1.00 74.32 H new ATOM 0 HB THR A 903 -7.760 -20.872 7.163 1.00 43.13 H new ATOM 0 HG1 THR A 903 -9.913 -21.653 7.989 1.00 4.15 H new ATOM 0 HG21 THR A 903 -8.128 -23.213 7.850 1.00 22.25 H new ATOM 0 HG22 THR A 903 -6.548 -22.639 8.434 1.00 22.25 H new ATOM 0 HG23 THR A 903 -7.923 -22.756 9.558 1.00 22.25 H new ATOM 1815 N LEU A 904 -7.341 -20.956 11.358 1.00 25.42 N ATOM 1816 CA LEU A 904 -6.754 -21.560 12.543 1.00 54.30 C ATOM 1817 C LEU A 904 -7.645 -22.710 13.018 1.00 44.11 C ATOM 1818 O LEU A 904 -8.818 -22.505 13.325 1.00 21.31 O ATOM 1819 CB LEU A 904 -6.498 -20.498 13.614 1.00 11.31 C ATOM 1820 CG LEU A 904 -6.910 -19.069 13.254 1.00 42.21 C ATOM 1821 CD1 LEU A 904 -8.409 -18.858 13.474 1.00 20.14 C ATOM 1822 CD2 LEU A 904 -6.068 -18.046 14.020 1.00 34.11 C ATOM 0 H LEU A 904 -8.339 -20.756 11.430 1.00 25.42 H new ATOM 0 HA LEU A 904 -5.778 -21.987 12.310 1.00 54.30 H new ATOM 0 HB2 LEU A 904 -7.028 -20.790 14.521 1.00 11.31 H new ATOM 0 HB3 LEU A 904 -5.434 -20.499 13.852 1.00 11.31 H new ATOM 0 HG LEU A 904 -6.716 -18.915 12.192 1.00 42.21 H new ATOM 0 HD11 LEU A 904 -8.675 -17.834 13.211 1.00 20.14 H new ATOM 0 HD12 LEU A 904 -8.970 -19.551 12.847 1.00 20.14 H new ATOM 0 HD13 LEU A 904 -8.652 -19.038 14.521 1.00 20.14 H new ATOM 0 HD21 LEU A 904 -6.381 -17.039 13.746 1.00 34.11 H new ATOM 0 HD22 LEU A 904 -6.207 -18.190 15.092 1.00 34.11 H new ATOM 0 HD23 LEU A 904 -5.016 -18.180 13.769 1.00 34.11 H new ATOM 1834 N TYR A 905 -7.053 -23.894 13.063 1.00 25.31 N ATOM 1835 CA TYR A 905 -7.777 -25.077 13.495 1.00 32.23 C ATOM 1836 C TYR A 905 -7.733 -25.222 15.018 1.00 41.51 C ATOM 1837 O TYR A 905 -7.292 -24.312 15.719 1.00 42.14 O ATOM 1838 CB TYR A 905 -7.057 -26.268 12.861 1.00 64.51 C ATOM 1839 CG TYR A 905 -6.831 -26.129 11.354 1.00 0.32 C ATOM 1840 CD1 TYR A 905 -7.852 -25.680 10.542 1.00 14.52 C ATOM 1841 CD2 TYR A 905 -5.606 -26.452 10.807 1.00 43.20 C ATOM 1842 CE1 TYR A 905 -7.640 -25.548 9.124 1.00 30.00 C ATOM 1843 CE2 TYR A 905 -5.393 -26.320 9.389 1.00 73.22 C ATOM 1844 CZ TYR A 905 -6.421 -25.875 8.617 1.00 0.13 C ATOM 1845 OH TYR A 905 -6.220 -25.751 7.278 1.00 53.40 O ATOM 0 H TYR A 905 -6.080 -24.060 12.807 1.00 25.31 H new ATOM 0 HA TYR A 905 -8.824 -25.015 13.198 1.00 32.23 H new ATOM 0 HB2 TYR A 905 -6.093 -26.400 13.352 1.00 64.51 H new ATOM 0 HB3 TYR A 905 -7.637 -27.172 13.049 1.00 64.51 H new ATOM 0 HD1 TYR A 905 -8.811 -25.427 10.970 1.00 14.52 H new ATOM 0 HD2 TYR A 905 -4.807 -26.804 11.443 1.00 43.20 H new ATOM 0 HE1 TYR A 905 -8.431 -25.197 8.478 1.00 30.00 H new ATOM 0 HE2 TYR A 905 -4.439 -26.569 8.948 1.00 73.22 H new ATOM 0 HH TYR A 905 -5.303 -26.019 7.059 1.00 53.40 H new ATOM 1855 N SER A 906 -8.196 -26.372 15.485 1.00 11.41 N ATOM 1856 CA SER A 906 -8.215 -26.647 16.912 1.00 41.33 C ATOM 1857 C SER A 906 -7.755 -28.082 17.174 1.00 62.21 C ATOM 1858 O SER A 906 -6.903 -28.318 18.029 1.00 63.41 O ATOM 1859 CB SER A 906 -9.610 -26.421 17.498 1.00 60.02 C ATOM 1860 OG SER A 906 -9.651 -26.687 18.897 1.00 24.12 O ATOM 0 H SER A 906 -8.561 -27.124 14.901 1.00 11.41 H new ATOM 0 HA SER A 906 -7.529 -25.957 17.403 1.00 41.33 H new ATOM 0 HB2 SER A 906 -9.917 -25.391 17.316 1.00 60.02 H new ATOM 0 HB3 SER A 906 -10.327 -27.063 16.986 1.00 60.02 H new ATOM 0 HG SER A 906 -10.558 -26.530 19.233 1.00 24.12 H new ATOM 1866 N LYS A 907 -8.339 -29.003 16.422 1.00 33.53 N ATOM 1867 CA LYS A 907 -8.000 -30.409 16.563 1.00 71.43 C ATOM 1868 C LYS A 907 -7.153 -30.847 15.366 1.00 31.11 C ATOM 1869 O LYS A 907 -7.245 -30.261 14.289 1.00 45.13 O ATOM 1870 CB LYS A 907 -9.264 -31.248 16.761 1.00 31.31 C ATOM 1871 CG LYS A 907 -8.969 -32.496 17.596 1.00 3.13 C ATOM 1872 CD LYS A 907 -9.164 -32.216 19.088 1.00 72.13 C ATOM 1873 CE LYS A 907 -7.984 -31.425 19.656 1.00 33.44 C ATOM 1874 NZ LYS A 907 -6.704 -31.970 19.152 1.00 60.13 N ATOM 0 H LYS A 907 -9.045 -28.803 15.713 1.00 33.53 H new ATOM 0 HA LYS A 907 -7.397 -30.568 17.457 1.00 71.43 H new ATOM 0 HB2 LYS A 907 -10.029 -30.649 17.254 1.00 31.31 H new ATOM 0 HB3 LYS A 907 -9.665 -31.542 15.791 1.00 31.31 H new ATOM 0 HG2 LYS A 907 -9.626 -33.309 17.286 1.00 3.13 H new ATOM 0 HG3 LYS A 907 -7.946 -32.826 17.415 1.00 3.13 H new ATOM 0 HD2 LYS A 907 -10.088 -31.657 19.239 1.00 72.13 H new ATOM 0 HD3 LYS A 907 -9.269 -33.157 19.628 1.00 72.13 H new ATOM 0 HE2 LYS A 907 -8.074 -30.375 19.377 1.00 33.44 H new ATOM 0 HE3 LYS A 907 -8.001 -31.468 20.745 1.00 33.44 H new ATOM 0 HZ1 LYS A 907 -5.913 -31.526 19.661 1.00 60.13 H new ATOM 0 HZ2 LYS A 907 -6.680 -32.998 19.305 1.00 60.13 H new ATOM 0 HZ3 LYS A 907 -6.618 -31.770 18.135 1.00 60.13 H new ATOM 1887 N TRP A 908 -6.348 -31.874 15.596 1.00 41.12 N ATOM 1888 CA TRP A 908 -5.485 -32.397 14.550 1.00 12.01 C ATOM 1889 C TRP A 908 -6.369 -33.088 13.510 1.00 61.12 C ATOM 1890 O TRP A 908 -5.964 -33.259 12.361 1.00 41.31 O ATOM 1891 CB TRP A 908 -4.415 -33.321 15.134 1.00 64.12 C ATOM 1892 CG TRP A 908 -3.688 -32.742 16.349 1.00 44.41 C ATOM 1893 CD1 TRP A 908 -2.718 -31.816 16.367 1.00 74.43 C ATOM 1894 CD2 TRP A 908 -3.913 -33.089 17.732 1.00 43.44 C ATOM 1895 NE1 TRP A 908 -2.304 -31.543 17.654 1.00 1.34 N ATOM 1896 CE2 TRP A 908 -3.053 -32.341 18.511 1.00 55.13 C ATOM 1897 CE3 TRP A 908 -4.813 -34.004 18.305 1.00 1.11 C ATOM 1898 CZ2 TRP A 908 -3.009 -32.432 19.907 1.00 13.30 C ATOM 1899 CZ3 TRP A 908 -4.756 -34.083 19.702 1.00 53.12 C ATOM 1900 CH2 TRP A 908 -3.897 -33.337 20.500 1.00 20.23 C ATOM 0 H TRP A 908 -6.275 -32.358 16.491 1.00 41.12 H new ATOM 0 HA TRP A 908 -4.938 -31.591 14.061 1.00 12.01 H new ATOM 0 HB2 TRP A 908 -4.880 -34.265 15.418 1.00 64.12 H new ATOM 0 HB3 TRP A 908 -3.683 -33.547 14.359 1.00 64.12 H new ATOM 0 HD1 TRP A 908 -2.312 -31.344 15.485 1.00 74.43 H new ATOM 0 HE1 TRP A 908 -1.581 -30.878 17.927 1.00 1.34 H new ATOM 0 HE3 TRP A 908 -5.494 -34.599 17.715 1.00 1.11 H new ATOM 0 HZ2 TRP A 908 -2.327 -31.836 20.495 1.00 13.30 H new ATOM 0 HZ3 TRP A 908 -5.427 -34.772 20.194 1.00 53.12 H new ATOM 0 HH2 TRP A 908 -3.915 -33.455 21.573 1.00 20.23 H new ATOM 1911 N LYS A 909 -7.560 -33.467 13.950 1.00 63.23 N ATOM 1912 CA LYS A 909 -8.504 -34.136 13.071 1.00 51.10 C ATOM 1913 C LYS A 909 -9.187 -33.098 12.178 1.00 4.32 C ATOM 1914 O LYS A 909 -9.836 -33.450 11.195 1.00 72.21 O ATOM 1915 CB LYS A 909 -9.483 -34.986 13.884 1.00 65.43 C ATOM 1916 CG LYS A 909 -10.632 -34.134 14.424 1.00 13.41 C ATOM 1917 CD LYS A 909 -11.623 -34.988 15.216 1.00 35.44 C ATOM 1918 CE LYS A 909 -12.774 -34.136 15.756 1.00 41.05 C ATOM 1919 NZ LYS A 909 -13.636 -33.668 14.647 1.00 21.11 N ATOM 0 H LYS A 909 -7.893 -33.324 14.903 1.00 63.23 H new ATOM 0 HA LYS A 909 -7.984 -34.831 12.412 1.00 51.10 H new ATOM 0 HB2 LYS A 909 -9.881 -35.786 13.259 1.00 65.43 H new ATOM 0 HB3 LYS A 909 -8.957 -35.460 14.712 1.00 65.43 H new ATOM 0 HG2 LYS A 909 -10.235 -33.345 15.063 1.00 13.41 H new ATOM 0 HG3 LYS A 909 -11.147 -33.646 13.597 1.00 13.41 H new ATOM 0 HD2 LYS A 909 -12.019 -35.778 14.577 1.00 35.44 H new ATOM 0 HD3 LYS A 909 -11.108 -35.476 16.044 1.00 35.44 H new ATOM 0 HE2 LYS A 909 -13.365 -34.718 16.463 1.00 41.05 H new ATOM 0 HE3 LYS A 909 -12.376 -33.280 16.302 1.00 41.05 H new ATOM 0 HZ1 LYS A 909 -14.515 -33.269 15.035 1.00 21.11 H new ATOM 0 HZ2 LYS A 909 -13.135 -32.938 14.102 1.00 21.11 H new ATOM 0 HZ3 LYS A 909 -13.865 -34.468 14.024 1.00 21.11 H new ATOM 1932 N ASP A 910 -9.016 -31.838 12.553 1.00 62.33 N ATOM 1933 CA ASP A 910 -9.607 -30.746 11.798 1.00 32.41 C ATOM 1934 C ASP A 910 -8.594 -30.233 10.773 1.00 1.12 C ATOM 1935 O ASP A 910 -8.793 -29.178 10.173 1.00 72.25 O ATOM 1936 CB ASP A 910 -9.982 -29.582 12.717 1.00 51.23 C ATOM 1937 CG ASP A 910 -10.545 -28.351 12.003 1.00 35.04 C ATOM 1938 OD1 ASP A 910 -10.199 -27.207 12.333 1.00 21.14 O ATOM 1939 OD2 ASP A 910 -11.386 -28.606 11.059 1.00 52.33 O ATOM 0 H ASP A 910 -8.477 -31.550 13.369 1.00 62.33 H new ATOM 0 HA ASP A 910 -10.505 -31.122 11.307 1.00 32.41 H new ATOM 0 HB2 ASP A 910 -10.718 -29.932 13.441 1.00 51.23 H new ATOM 0 HB3 ASP A 910 -9.098 -29.284 13.281 1.00 51.23 H new ATOM 1945 N PHE A 911 -7.529 -31.003 10.605 1.00 43.50 N ATOM 1946 CA PHE A 911 -6.484 -30.639 9.663 1.00 3.32 C ATOM 1947 C PHE A 911 -6.944 -30.860 8.221 1.00 52.41 C ATOM 1948 O PHE A 911 -7.850 -31.652 7.969 1.00 33.53 O ATOM 1949 CB PHE A 911 -5.287 -31.549 9.949 1.00 54.40 C ATOM 1950 CG PHE A 911 -5.375 -32.921 9.279 1.00 74.24 C ATOM 1951 CD1 PHE A 911 -6.574 -33.557 9.187 1.00 62.44 C ATOM 1952 CD2 PHE A 911 -4.255 -33.505 8.775 1.00 51.14 C ATOM 1953 CE1 PHE A 911 -6.656 -34.831 8.564 1.00 25.24 C ATOM 1954 CE2 PHE A 911 -4.337 -34.779 8.152 1.00 2.45 C ATOM 1955 CZ PHE A 911 -5.535 -35.415 8.060 1.00 12.04 C ATOM 0 H PHE A 911 -7.367 -31.877 11.105 1.00 43.50 H new ATOM 0 HA PHE A 911 -6.231 -29.585 9.778 1.00 3.32 H new ATOM 0 HB2 PHE A 911 -4.377 -31.051 9.615 1.00 54.40 H new ATOM 0 HB3 PHE A 911 -5.198 -31.687 11.027 1.00 54.40 H new ATOM 0 HD1 PHE A 911 -7.463 -33.093 9.588 1.00 62.44 H new ATOM 0 HD2 PHE A 911 -3.303 -33.000 8.848 1.00 51.14 H new ATOM 0 HE1 PHE A 911 -7.608 -35.336 8.490 1.00 25.24 H new ATOM 0 HE2 PHE A 911 -3.448 -35.242 7.751 1.00 2.45 H new ATOM 0 HZ PHE A 911 -5.597 -36.384 7.587 1.00 12.04 H new ATOM 1965 N HIS A 912 -6.299 -30.144 7.311 1.00 31.23 N ATOM 1966 CA HIS A 912 -6.631 -30.252 5.901 1.00 71.02 C ATOM 1967 C HIS A 912 -5.382 -30.642 5.108 1.00 41.41 C ATOM 1968 O HIS A 912 -5.349 -30.502 3.886 1.00 31.12 O ATOM 1969 CB HIS A 912 -7.276 -28.960 5.394 1.00 31.53 C ATOM 1970 CG HIS A 912 -7.968 -29.102 4.059 1.00 20.05 C ATOM 1971 ND1 HIS A 912 -9.061 -29.929 3.865 1.00 1.45 N ATOM 1972 CD2 HIS A 912 -7.712 -28.513 2.856 1.00 62.50 C ATOM 1973 CE1 HIS A 912 -9.437 -29.835 2.598 1.00 4.24 C ATOM 1974 NE2 HIS A 912 -8.599 -28.958 1.974 1.00 1.33 N ATOM 0 H HIS A 912 -5.548 -29.487 7.523 1.00 31.23 H new ATOM 0 HA HIS A 912 -7.371 -31.039 5.757 1.00 71.02 H new ATOM 0 HB2 HIS A 912 -8.000 -28.613 6.132 1.00 31.53 H new ATOM 0 HB3 HIS A 912 -6.509 -28.190 5.314 1.00 31.53 H new ATOM 0 HD2 HIS A 912 -6.922 -27.805 2.655 1.00 62.50 H new ATOM 0 HE1 HIS A 912 -10.262 -30.360 2.140 1.00 4.24 H new ATOM 0 HE2 HIS A 912 -8.646 -28.688 0.991 1.00 1.33 H new ATOM 1982 N PHE A 913 -4.384 -31.122 5.835 1.00 34.24 N ATOM 1983 CA PHE A 913 -3.136 -31.533 5.215 1.00 11.05 C ATOM 1984 C PHE A 913 -3.135 -33.036 4.928 1.00 52.21 C ATOM 1985 O PHE A 913 -4.166 -33.696 5.052 1.00 42.34 O ATOM 1986 CB PHE A 913 -2.017 -31.215 6.210 1.00 73.35 C ATOM 1987 CG PHE A 913 -2.023 -29.770 6.711 1.00 4.21 C ATOM 1988 CD1 PHE A 913 -1.614 -28.764 5.892 1.00 62.23 C ATOM 1989 CD2 PHE A 913 -2.436 -29.491 7.976 1.00 1.43 C ATOM 1990 CE1 PHE A 913 -1.619 -27.423 6.357 1.00 4.23 C ATOM 1991 CE2 PHE A 913 -2.441 -28.149 8.442 1.00 64.01 C ATOM 1992 CZ PHE A 913 -2.032 -27.143 7.622 1.00 22.45 C ATOM 0 H PHE A 913 -4.414 -31.236 6.848 1.00 34.24 H new ATOM 0 HA PHE A 913 -3.000 -31.010 4.269 1.00 11.05 H new ATOM 0 HB2 PHE A 913 -2.103 -31.886 7.065 1.00 73.35 H new ATOM 0 HB3 PHE A 913 -1.056 -31.421 5.739 1.00 73.35 H new ATOM 0 HD1 PHE A 913 -1.285 -28.986 4.887 1.00 62.23 H new ATOM 0 HD2 PHE A 913 -2.760 -30.290 8.627 1.00 1.43 H new ATOM 0 HE1 PHE A 913 -1.295 -26.625 5.706 1.00 4.23 H new ATOM 0 HE2 PHE A 913 -2.769 -27.927 9.447 1.00 64.01 H new ATOM 0 HZ PHE A 913 -2.035 -26.123 7.976 1.00 22.45 H new ATOM 2002 N GLU A 914 -1.967 -33.533 4.550 1.00 43.34 N ATOM 2003 CA GLU A 914 -1.818 -34.945 4.243 1.00 30.34 C ATOM 2004 C GLU A 914 -0.552 -35.500 4.900 1.00 72.34 C ATOM 2005 O GLU A 914 0.417 -34.771 5.103 1.00 51.51 O ATOM 2006 CB GLU A 914 -1.800 -35.180 2.732 1.00 42.23 C ATOM 2007 CG GLU A 914 -0.415 -34.891 2.149 1.00 61.43 C ATOM 2008 CD GLU A 914 -0.494 -34.653 0.639 1.00 31.34 C ATOM 2009 OE1 GLU A 914 -0.452 -33.498 0.191 1.00 64.01 O ATOM 2010 OE2 GLU A 914 -0.602 -35.721 -0.076 1.00 75.21 O ATOM 0 H GLU A 914 -1.114 -32.983 4.449 1.00 43.34 H new ATOM 0 HA GLU A 914 -2.678 -35.477 4.649 1.00 30.34 H new ATOM 0 HB2 GLU A 914 -2.081 -36.211 2.517 1.00 42.23 H new ATOM 0 HB3 GLU A 914 -2.541 -34.541 2.252 1.00 42.23 H new ATOM 0 HG2 GLU A 914 0.013 -34.015 2.637 1.00 61.43 H new ATOM 0 HG3 GLU A 914 0.252 -35.728 2.354 1.00 61.43 H new ATOM 2018 N LYS A 915 -0.602 -36.787 5.213 1.00 44.33 N ATOM 2019 CA LYS A 915 0.529 -37.448 5.842 1.00 41.14 C ATOM 2020 C LYS A 915 1.673 -37.563 4.832 1.00 2.12 C ATOM 2021 O LYS A 915 1.482 -38.065 3.726 1.00 75.31 O ATOM 2022 CB LYS A 915 0.100 -38.789 6.441 1.00 43.14 C ATOM 2023 CG LYS A 915 -0.509 -39.697 5.371 1.00 73.31 C ATOM 2024 CD LYS A 915 -0.236 -41.170 5.682 1.00 35.30 C ATOM 2025 CE LYS A 915 1.076 -41.631 5.044 1.00 34.44 C ATOM 2026 NZ LYS A 915 1.134 -43.109 4.990 1.00 23.33 N ATOM 0 H LYS A 915 -1.408 -37.389 5.043 1.00 44.33 H new ATOM 0 HA LYS A 915 0.900 -36.856 6.678 1.00 41.14 H new ATOM 0 HB2 LYS A 915 0.961 -39.281 6.894 1.00 43.14 H new ATOM 0 HB3 LYS A 915 -0.626 -38.621 7.236 1.00 43.14 H new ATOM 0 HG2 LYS A 915 -1.584 -39.527 5.314 1.00 73.31 H new ATOM 0 HG3 LYS A 915 -0.094 -39.445 4.395 1.00 73.31 H new ATOM 0 HD2 LYS A 915 -0.190 -41.315 6.761 1.00 35.30 H new ATOM 0 HD3 LYS A 915 -1.059 -41.782 5.313 1.00 35.30 H new ATOM 0 HE2 LYS A 915 1.162 -41.221 4.038 1.00 34.44 H new ATOM 0 HE3 LYS A 915 1.920 -41.249 5.617 1.00 34.44 H new ATOM 0 HZ1 LYS A 915 2.031 -43.406 4.554 1.00 23.33 H new ATOM 0 HZ2 LYS A 915 1.073 -43.494 5.954 1.00 23.33 H new ATOM 0 HZ3 LYS A 915 0.339 -43.467 4.424 1.00 23.33 H new ATOM 2039 N ILE A 916 2.838 -37.089 5.250 1.00 52.14 N ATOM 2040 CA ILE A 916 4.013 -37.132 4.396 1.00 72.23 C ATOM 2041 C ILE A 916 5.202 -37.665 5.198 1.00 14.11 C ATOM 2042 O ILE A 916 5.364 -37.331 6.371 1.00 54.54 O ATOM 2043 CB ILE A 916 4.264 -35.763 3.760 1.00 72.41 C ATOM 2044 CG1 ILE A 916 3.021 -35.268 3.018 1.00 41.54 C ATOM 2045 CG2 ILE A 916 5.497 -35.797 2.855 1.00 71.23 C ATOM 2046 CD1 ILE A 916 3.028 -33.743 2.894 1.00 45.50 C ATOM 0 H ILE A 916 2.993 -36.673 6.168 1.00 52.14 H new ATOM 0 HA ILE A 916 3.855 -37.819 3.565 1.00 72.23 H new ATOM 0 HB ILE A 916 4.470 -35.048 4.557 1.00 72.41 H new ATOM 0 HG12 ILE A 916 2.983 -35.717 2.026 1.00 41.54 H new ATOM 0 HG13 ILE A 916 2.124 -35.589 3.548 1.00 41.54 H new ATOM 0 HG21 ILE A 916 5.653 -34.812 2.416 1.00 71.23 H new ATOM 0 HG22 ILE A 916 6.372 -36.075 3.443 1.00 71.23 H new ATOM 0 HG23 ILE A 916 5.346 -36.528 2.061 1.00 71.23 H new ATOM 0 HD11 ILE A 916 2.134 -33.417 2.363 1.00 45.50 H new ATOM 0 HD12 ILE A 916 3.042 -33.297 3.889 1.00 45.50 H new ATOM 0 HD13 ILE A 916 3.913 -33.427 2.342 1.00 45.50 H new ATOM 2058 N PRO A 917 6.024 -38.507 4.517 1.00 40.24 N ATOM 2059 CA PRO A 917 7.193 -39.089 5.153 1.00 22.02 C ATOM 2060 C PRO A 917 8.312 -38.055 5.295 1.00 21.23 C ATOM 2061 O PRO A 917 8.740 -37.458 4.308 1.00 34.34 O ATOM 2062 CB PRO A 917 7.579 -40.264 4.269 1.00 15.30 C ATOM 2063 CG PRO A 917 6.902 -40.018 2.930 1.00 13.44 C ATOM 2064 CD PRO A 917 5.863 -38.925 3.127 1.00 23.21 C ATOM 0 HA PRO A 917 6.995 -39.423 6.172 1.00 22.02 H new ATOM 0 HB2 PRO A 917 8.661 -40.327 4.154 1.00 15.30 H new ATOM 0 HB3 PRO A 917 7.249 -41.207 4.706 1.00 15.30 H new ATOM 0 HG2 PRO A 917 7.635 -39.718 2.181 1.00 13.44 H new ATOM 0 HG3 PRO A 917 6.431 -40.931 2.567 1.00 13.44 H new ATOM 0 HD2 PRO A 917 6.028 -38.094 2.442 1.00 23.21 H new ATOM 0 HD3 PRO A 917 4.856 -39.297 2.940 1.00 23.21 H new ATOM 2072 N PHE A 918 8.755 -37.875 6.531 1.00 34.41 N ATOM 2073 CA PHE A 918 9.816 -36.924 6.815 1.00 32.21 C ATOM 2074 C PHE A 918 11.142 -37.384 6.206 1.00 30.45 C ATOM 2075 O PHE A 918 11.609 -38.487 6.488 1.00 74.23 O ATOM 2076 CB PHE A 918 9.962 -36.859 8.337 1.00 41.54 C ATOM 2077 CG PHE A 918 10.364 -35.480 8.864 1.00 14.42 C ATOM 2078 CD1 PHE A 918 9.440 -34.484 8.936 1.00 1.23 C ATOM 2079 CD2 PHE A 918 11.644 -35.250 9.261 1.00 51.42 C ATOM 2080 CE1 PHE A 918 9.813 -33.204 9.426 1.00 73.02 C ATOM 2081 CE2 PHE A 918 12.017 -33.970 9.750 1.00 14.23 C ATOM 2082 CZ PHE A 918 11.093 -32.974 9.822 1.00 1.05 C ATOM 0 H PHE A 918 8.398 -38.372 7.347 1.00 34.41 H new ATOM 0 HA PHE A 918 9.569 -35.952 6.388 1.00 32.21 H new ATOM 0 HB2 PHE A 918 9.017 -37.151 8.795 1.00 41.54 H new ATOM 0 HB3 PHE A 918 10.708 -37.589 8.652 1.00 41.54 H new ATOM 0 HD1 PHE A 918 8.423 -34.667 8.621 1.00 1.23 H new ATOM 0 HD2 PHE A 918 12.377 -36.041 9.204 1.00 51.42 H new ATOM 0 HE1 PHE A 918 9.080 -32.413 9.484 1.00 73.02 H new ATOM 0 HE2 PHE A 918 13.034 -33.787 10.065 1.00 14.23 H new ATOM 0 HZ PHE A 918 11.376 -32.000 10.194 1.00 1.05 H new ATOM 2092 N ASP A 919 11.712 -36.516 5.384 1.00 73.12 N ATOM 2093 CA ASP A 919 12.975 -36.820 4.733 1.00 10.51 C ATOM 2094 C ASP A 919 14.068 -35.912 5.302 1.00 33.32 C ATOM 2095 O ASP A 919 13.834 -34.729 5.543 1.00 21.01 O ATOM 2096 CB ASP A 919 12.892 -36.571 3.226 1.00 53.12 C ATOM 2097 CG ASP A 919 12.590 -37.811 2.382 1.00 42.24 C ATOM 2098 OD1 ASP A 919 11.596 -38.515 2.613 1.00 2.13 O ATOM 2099 OD2 ASP A 919 13.438 -38.047 1.438 1.00 32.43 O ATOM 0 H ASP A 919 11.323 -35.602 5.154 1.00 73.12 H new ATOM 0 HA ASP A 919 13.203 -37.871 4.913 1.00 10.51 H new ATOM 0 HB2 ASP A 919 12.120 -35.825 3.038 1.00 53.12 H new ATOM 0 HB3 ASP A 919 13.837 -36.143 2.891 1.00 53.12 H new ATOM 2105 N PRO A 920 15.269 -36.517 5.506 1.00 74.30 N ATOM 2106 CA PRO A 920 16.398 -35.777 6.042 1.00 21.22 C ATOM 2107 C PRO A 920 17.003 -34.856 4.981 1.00 2.44 C ATOM 2108 O PRO A 920 17.660 -33.870 5.312 1.00 1.42 O ATOM 2109 CB PRO A 920 17.369 -36.840 6.530 1.00 42.03 C ATOM 2110 CG PRO A 920 16.962 -38.128 5.832 1.00 3.21 C ATOM 2111 CD PRO A 920 15.582 -37.917 5.232 1.00 12.22 C ATOM 0 HA PRO A 920 16.116 -35.110 6.857 1.00 21.22 H new ATOM 0 HB2 PRO A 920 18.397 -36.572 6.286 1.00 42.03 H new ATOM 0 HB3 PRO A 920 17.316 -36.949 7.613 1.00 42.03 H new ATOM 0 HG2 PRO A 920 17.681 -38.384 5.054 1.00 3.21 H new ATOM 0 HG3 PRO A 920 16.948 -38.957 6.539 1.00 3.21 H new ATOM 0 HD2 PRO A 920 15.580 -38.121 4.161 1.00 12.22 H new ATOM 0 HD3 PRO A 920 14.847 -38.583 5.685 1.00 12.22 H new ATOM 2119 N ALA A 921 16.760 -35.209 3.728 1.00 61.31 N ATOM 2120 CA ALA A 921 17.273 -34.426 2.616 1.00 32.25 C ATOM 2121 C ALA A 921 16.638 -33.034 2.644 1.00 65.14 C ATOM 2122 O ALA A 921 17.123 -32.115 1.985 1.00 15.45 O ATOM 2123 CB ALA A 921 17.003 -35.165 1.304 1.00 54.40 C ATOM 0 H ALA A 921 16.214 -36.027 3.457 1.00 61.31 H new ATOM 0 HA ALA A 921 18.352 -34.298 2.701 1.00 32.25 H new ATOM 0 HB1 ALA A 921 17.388 -34.578 0.470 1.00 54.40 H new ATOM 0 HB2 ALA A 921 17.499 -36.135 1.324 1.00 54.40 H new ATOM 0 HB3 ALA A 921 15.929 -35.309 1.182 1.00 54.40 H new ATOM 2129 N GLU A 922 15.565 -32.923 3.412 1.00 53.03 N ATOM 2130 CA GLU A 922 14.859 -31.659 3.533 1.00 1.42 C ATOM 2131 C GLU A 922 15.355 -30.890 4.759 1.00 1.35 C ATOM 2132 O GLU A 922 15.422 -29.662 4.741 1.00 12.43 O ATOM 2133 CB GLU A 922 13.347 -31.879 3.599 1.00 15.11 C ATOM 2134 CG GLU A 922 12.938 -33.118 2.801 1.00 74.43 C ATOM 2135 CD GLU A 922 11.504 -32.988 2.283 1.00 72.54 C ATOM 2136 OE1 GLU A 922 10.634 -32.459 2.991 1.00 45.23 O ATOM 2137 OE2 GLU A 922 11.307 -33.460 1.098 1.00 22.43 O ATOM 0 H GLU A 922 15.167 -33.688 3.957 1.00 53.03 H new ATOM 0 HA GLU A 922 15.067 -31.063 2.645 1.00 1.42 H new ATOM 0 HB2 GLU A 922 13.037 -31.993 4.638 1.00 15.11 H new ATOM 0 HB3 GLU A 922 12.831 -31.003 3.207 1.00 15.11 H new ATOM 0 HG2 GLU A 922 13.620 -33.256 1.962 1.00 74.43 H new ATOM 0 HG3 GLU A 922 13.022 -34.004 3.430 1.00 74.43 H new ATOM 2145 N MET A 923 15.690 -31.644 5.796 1.00 62.23 N ATOM 2146 CA MET A 923 16.178 -31.049 7.028 1.00 1.12 C ATOM 2147 C MET A 923 17.486 -30.291 6.791 1.00 70.11 C ATOM 2148 O MET A 923 17.658 -29.175 7.278 1.00 10.12 O ATOM 2149 CB MET A 923 16.405 -32.146 8.070 1.00 24.01 C ATOM 2150 CG MET A 923 16.537 -31.551 9.473 1.00 1.44 C ATOM 2151 SD MET A 923 17.251 -32.754 10.582 1.00 14.54 S ATOM 2152 CE MET A 923 15.834 -33.805 10.852 1.00 34.02 C ATOM 0 H MET A 923 15.633 -32.662 5.808 1.00 62.23 H new ATOM 0 HA MET A 923 15.431 -30.342 7.389 1.00 1.12 H new ATOM 0 HB2 MET A 923 15.575 -32.852 8.047 1.00 24.01 H new ATOM 0 HB3 MET A 923 17.306 -32.707 7.823 1.00 24.01 H new ATOM 0 HG2 MET A 923 17.161 -30.658 9.441 1.00 1.44 H new ATOM 0 HG3 MET A 923 15.558 -31.242 9.840 1.00 1.44 H new ATOM 0 HE1 MET A 923 16.159 -34.843 10.919 1.00 34.02 H new ATOM 0 HE2 MET A 923 15.340 -33.519 11.781 1.00 34.02 H new ATOM 0 HE3 MET A 923 15.137 -33.696 10.022 1.00 34.02 H new ATOM 2162 N SER A 924 18.374 -30.928 6.042 1.00 23.23 N ATOM 2163 CA SER A 924 19.661 -30.328 5.735 1.00 64.15 C ATOM 2164 C SER A 924 20.237 -30.949 4.460 1.00 21.43 C ATOM 2165 O SER A 924 19.693 -31.922 3.939 1.00 41.41 O ATOM 2166 CB SER A 924 20.641 -30.499 6.897 1.00 12.45 C ATOM 2167 OG SER A 924 20.070 -30.095 8.139 1.00 22.34 O ATOM 0 H SER A 924 18.228 -31.853 5.639 1.00 23.23 H new ATOM 0 HA SER A 924 19.511 -29.260 5.577 1.00 64.15 H new ATOM 0 HB2 SER A 924 20.949 -31.543 6.962 1.00 12.45 H new ATOM 0 HB3 SER A 924 21.540 -29.913 6.703 1.00 12.45 H new ATOM 0 HG SER A 924 20.725 -30.221 8.857 1.00 22.34 H new ATOM 2173 N LYS A 925 21.330 -30.362 3.996 1.00 62.43 N ATOM 2174 CA LYS A 925 21.986 -30.846 2.793 1.00 73.25 C ATOM 2175 C LYS A 925 22.447 -32.288 3.013 1.00 24.00 C ATOM 2176 O LYS A 925 22.431 -33.097 2.087 1.00 64.32 O ATOM 2177 CB LYS A 925 23.111 -29.897 2.377 1.00 42.31 C ATOM 2178 CG LYS A 925 23.714 -30.315 1.034 1.00 20.54 C ATOM 2179 CD LYS A 925 24.802 -29.335 0.592 1.00 54.51 C ATOM 2180 CE LYS A 925 26.045 -29.460 1.475 1.00 50.24 C ATOM 2181 NZ LYS A 925 26.989 -28.354 1.199 1.00 25.14 N ATOM 0 H LYS A 925 21.778 -29.556 4.431 1.00 62.43 H new ATOM 0 HA LYS A 925 21.287 -30.859 1.957 1.00 73.25 H new ATOM 0 HB2 LYS A 925 22.726 -28.880 2.306 1.00 42.31 H new ATOM 0 HB3 LYS A 925 23.888 -29.891 3.142 1.00 42.31 H new ATOM 0 HG2 LYS A 925 24.134 -31.317 1.116 1.00 20.54 H new ATOM 0 HG3 LYS A 925 22.930 -30.359 0.278 1.00 20.54 H new ATOM 0 HD2 LYS A 925 25.069 -29.527 -0.447 1.00 54.51 H new ATOM 0 HD3 LYS A 925 24.419 -28.316 0.639 1.00 54.51 H new ATOM 0 HE2 LYS A 925 25.755 -29.445 2.526 1.00 50.24 H new ATOM 0 HE3 LYS A 925 26.533 -30.417 1.293 1.00 50.24 H new ATOM 0 HZ1 LYS A 925 27.827 -28.453 1.806 1.00 25.14 H new ATOM 0 HZ2 LYS A 925 27.279 -28.386 0.201 1.00 25.14 H new ATOM 0 HZ3 LYS A 925 26.525 -27.444 1.396 1.00 25.14 H new